USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1100 hydrogens (14 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: B 36 ALY H2 : B 36 ALY N : B 35 VAL C :(H bumps) USER MOD Set 1.1: A 803 ASN : amide:sc= -4.71! X(o=-7.6!,f=-7.4) USER MOD Set 1.2: A 807 SER OG : rot 169:sc= 0.846 USER MOD Set 1.3: B 39 HIS : no HE2:sc= -3.7 K(o=-7.6,f=-10!) USER MOD Set 2.1: A 798 ASN : amide:sc= -7.56! C(o=-16!,f=-19!) USER MOD Set 2.2: A 799 CYS SG : rot -138:sc= -8.04! USER MOD Set 3.1: A 789 MET CE :methyl -135:sc= -12.8! (180deg=-11.5!) USER MOD Set 3.2: A 793 GLN : amide:sc= -6.01! K(o=-19!,f=-14) USER MOD Set 3.3: A 832 LYS NZ :NH3+ 172:sc= 0.326 (180deg=0) USER MOD Set 4.1: A 784 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 786 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.212) USER MOD Set 5.1: A 773 MET CE :methyl -114:sc= -10.7! (180deg=-12.4!) USER MOD Set 5.2: A 782 TYR OH : rot -38:sc= -5.17! USER MOD Set 6.1: A 730 SER OG : rot 180:sc= -0.0122 USER MOD Set 6.2: A 733 LYS NZ :NH3+ 165:sc= -0.895 (180deg=-1.27) USER MOD Single : A 716 SER OG : rot 180:sc= -0.0608 USER MOD Single : A 717 HIS : no HD1:sc= -0.161 X(o=-0.16,f=0) USER MOD Single : A 718 MET CE :methyl 162:sc= -0.113 (180deg=-0.594) USER MOD Single : A 719 SER OG : rot 180:sc= 0 USER MOD Single : A 720 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 727 GLN : amide:sc= -0.0828 K(o=-0.083,f=-2.4!) USER MOD Single : A 729 TYR OH : rot 180:sc= 0 USER MOD Single : A 731 THR OG1 : rot 86:sc= 1.21 USER MOD Single : A 734 SER OG : rot 68:sc= 0.112 USER MOD Single : A 737 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 738 GLN : amide:sc= -5.01! K(o=-5!,f=-0.73) USER MOD Single : A 740 LYS NZ :NH3+ -156:sc= -0.503 (180deg=-1.84!) USER MOD Single : A 741 SER OG : rot -43:sc= 0.0435 USER MOD Single : A 742 HIS : no HD1:sc= -11.7! C(o=-12!,f=-21!) USER MOD Single : A 743 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 744 SER OG : rot 70:sc= -1.1 USER MOD Single : A 749 MET CE :methyl 132:sc= -4.02! (180deg=-8.41!) USER MOD Single : A 753 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 755 THR OG1 : rot 180:sc= 0 USER MOD Single : A 760 TYR OH : rot 180:sc= -0.383 USER MOD Single : A 761 TYR OH : rot 180:sc= 0 USER MOD Single : A 768 MET CE :methyl -170:sc= -5.72! (180deg=-6.12!) USER MOD Single : A 771 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0393) USER MOD Single : A 772 THR OG1 : rot 180:sc= -0.811 USER MOD Single : A 774 SER OG : rot -18:sc= -0.312 USER MOD Single : A 778 LYS NZ :NH3+ 168:sc=-0.00164 (180deg=-0.0935) USER MOD Single : A 779 ASN : amide:sc= -8.51! C(o=-8.5!,f=-3.8!) USER MOD Single : A 781 TYR OH : rot 180:sc= -0.886 USER MOD Single : A 785 LYS NZ :NH3+ -152:sc= -2.07 (180deg=-3.57!) USER MOD Single : A 797 THR OG1 : rot -69:sc= 1.28 USER MOD Single : A 800 LYS NZ :NH3+ -172:sc= -0.577 (180deg=-0.692) USER MOD Single : A 802 TYR OH : rot 91:sc= -1.64! USER MOD Single : A 809 TYR OH : rot -60:sc= -0.64 USER MOD Single : A 810 TYR OH : rot 180:sc= 0 USER MOD Single : A 811 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 812 CYS SG : rot 44:sc= -4.7! USER MOD Single : A 814 ASN : amide:sc= -0.211 K(o=-0.21,f=-1.2!) USER MOD Single : A 818 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0528) USER MOD Single : A 822 SER OG : rot 180:sc= 0 USER MOD Single : A 823 LYS NZ :NH3+ -144:sc= 1.66 (180deg=-0.413) USER MOD Single : A 825 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 SER OG : rot 180:sc= -0.094 USER MOD Single : B 32 THR OG1 : rot 180:sc= 0 USER MOD Single : B 37 LYS NZ :NH3+ -169:sc= -0.013 (180deg=-0.158) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 715 -28.668 6.058 -12.202 1.00 0.00 N ATOM 2 CA GLY A 715 -28.313 6.425 -10.803 1.00 0.00 C ATOM 3 C GLY A 715 -27.359 5.432 -10.168 1.00 0.00 C ATOM 4 O GLY A 715 -26.560 4.799 -10.859 1.00 0.00 O ATOM 0 HA2 GLY A 715 -27.860 7.416 -10.794 1.00 0.00 H new ATOM 0 HA3 GLY A 715 -29.222 6.485 -10.204 1.00 0.00 H new ATOM 10 N SER A 716 -27.443 5.294 -8.848 1.00 0.00 N ATOM 11 CA SER A 716 -26.582 4.370 -8.119 1.00 0.00 C ATOM 12 C SER A 716 -27.144 4.085 -6.729 1.00 0.00 C ATOM 13 O SER A 716 -27.973 4.838 -6.218 1.00 0.00 O ATOM 14 CB SER A 716 -25.168 4.941 -8.002 1.00 0.00 C ATOM 15 OG SER A 716 -24.316 4.053 -7.300 1.00 0.00 O ATOM 0 H SER A 716 -28.099 5.811 -8.262 1.00 0.00 H new ATOM 0 HA SER A 716 -26.543 3.434 -8.675 1.00 0.00 H new ATOM 0 HB2 SER A 716 -24.764 5.127 -8.997 1.00 0.00 H new ATOM 0 HB3 SER A 716 -25.202 5.901 -7.487 1.00 0.00 H new ATOM 0 HG SER A 716 -23.418 4.440 -7.240 1.00 0.00 H new ATOM 21 N HIS A 717 -26.687 2.992 -6.126 1.00 0.00 N ATOM 22 CA HIS A 717 -27.144 2.606 -4.796 1.00 0.00 C ATOM 23 C HIS A 717 -26.052 1.847 -4.046 1.00 0.00 C ATOM 24 O HIS A 717 -26.338 1.008 -3.192 1.00 0.00 O ATOM 25 CB HIS A 717 -28.407 1.745 -4.898 1.00 0.00 C ATOM 26 CG HIS A 717 -28.188 0.432 -5.586 1.00 0.00 C ATOM 27 ND1 HIS A 717 -28.422 -0.783 -4.978 1.00 0.00 N ATOM 28 CD2 HIS A 717 -27.757 0.147 -6.838 1.00 0.00 C ATOM 29 CE1 HIS A 717 -28.143 -1.759 -5.825 1.00 0.00 C ATOM 30 NE2 HIS A 717 -27.739 -1.220 -6.961 1.00 0.00 N ATOM 0 H HIS A 717 -26.001 2.359 -6.537 1.00 0.00 H new ATOM 0 HA HIS A 717 -27.377 3.514 -4.239 1.00 0.00 H new ATOM 0 HB2 HIS A 717 -28.791 1.560 -3.895 1.00 0.00 H new ATOM 0 HB3 HIS A 717 -29.174 2.303 -5.435 1.00 0.00 H new ATOM 0 HD2 HIS A 717 -27.479 0.862 -7.598 1.00 0.00 H new ATOM 0 HE1 HIS A 717 -28.230 -2.816 -5.623 1.00 0.00 H new ATOM 0 HE2 HIS A 717 -27.459 -1.736 -7.795 1.00 0.00 H new ATOM 39 N MET A 718 -24.799 2.152 -4.372 1.00 0.00 N ATOM 40 CA MET A 718 -23.660 1.499 -3.735 1.00 0.00 C ATOM 41 C MET A 718 -23.454 2.013 -2.314 1.00 0.00 C ATOM 42 O MET A 718 -22.568 1.547 -1.597 1.00 0.00 O ATOM 43 CB MET A 718 -22.391 1.725 -4.559 1.00 0.00 C ATOM 44 CG MET A 718 -22.477 1.173 -5.973 1.00 0.00 C ATOM 45 SD MET A 718 -20.982 1.487 -6.934 1.00 0.00 S ATOM 46 CE MET A 718 -19.774 0.555 -5.997 1.00 0.00 C ATOM 0 H MET A 718 -24.547 2.848 -5.074 1.00 0.00 H new ATOM 0 HA MET A 718 -23.871 0.431 -3.685 1.00 0.00 H new ATOM 0 HB2 MET A 718 -22.185 2.794 -4.607 1.00 0.00 H new ATOM 0 HB3 MET A 718 -21.548 1.261 -4.047 1.00 0.00 H new ATOM 0 HG2 MET A 718 -22.657 0.099 -5.929 1.00 0.00 H new ATOM 0 HG3 MET A 718 -23.332 1.619 -6.482 1.00 0.00 H new ATOM 0 HE1 MET A 718 -18.892 0.381 -6.613 1.00 0.00 H new ATOM 0 HE2 MET A 718 -19.490 1.118 -5.108 1.00 0.00 H new ATOM 0 HE3 MET A 718 -20.204 -0.402 -5.699 1.00 0.00 H new ATOM 56 N SER A 719 -24.280 2.980 -1.916 1.00 0.00 N ATOM 57 CA SER A 719 -24.199 3.565 -0.580 1.00 0.00 C ATOM 58 C SER A 719 -22.805 4.126 -0.313 1.00 0.00 C ATOM 59 O SER A 719 -22.329 4.108 0.822 1.00 0.00 O ATOM 60 CB SER A 719 -24.553 2.519 0.479 1.00 0.00 C ATOM 61 OG SER A 719 -25.847 1.988 0.259 1.00 0.00 O ATOM 0 H SER A 719 -25.015 3.375 -2.503 1.00 0.00 H new ATOM 0 HA SER A 719 -24.916 4.385 -0.526 1.00 0.00 H new ATOM 0 HB2 SER A 719 -23.818 1.714 0.459 1.00 0.00 H new ATOM 0 HB3 SER A 719 -24.505 2.970 1.470 1.00 0.00 H new ATOM 0 HG SER A 719 -26.048 1.321 0.948 1.00 0.00 H new ATOM 67 N LYS A 720 -22.164 4.623 -1.374 1.00 0.00 N ATOM 68 CA LYS A 720 -20.820 5.195 -1.287 1.00 0.00 C ATOM 69 C LYS A 720 -19.916 4.356 -0.388 1.00 0.00 C ATOM 70 O LYS A 720 -19.096 4.888 0.360 1.00 0.00 O ATOM 71 CB LYS A 720 -20.869 6.650 -0.798 1.00 0.00 C ATOM 72 CG LYS A 720 -21.338 6.814 0.642 1.00 0.00 C ATOM 73 CD LYS A 720 -21.190 8.253 1.116 1.00 0.00 C ATOM 74 CE LYS A 720 -19.728 8.663 1.214 1.00 0.00 C ATOM 75 NZ LYS A 720 -19.576 10.088 1.619 1.00 0.00 N ATOM 0 H LYS A 720 -22.561 4.640 -2.313 1.00 0.00 H new ATOM 0 HA LYS A 720 -20.396 5.187 -2.291 1.00 0.00 H new ATOM 0 HB2 LYS A 720 -19.875 7.087 -0.896 1.00 0.00 H new ATOM 0 HB3 LYS A 720 -21.532 7.218 -1.450 1.00 0.00 H new ATOM 0 HG2 LYS A 720 -22.381 6.508 0.723 1.00 0.00 H new ATOM 0 HG3 LYS A 720 -20.761 6.155 1.291 1.00 0.00 H new ATOM 0 HD2 LYS A 720 -21.710 8.919 0.427 1.00 0.00 H new ATOM 0 HD3 LYS A 720 -21.666 8.367 2.090 1.00 0.00 H new ATOM 0 HE2 LYS A 720 -19.220 8.024 1.936 1.00 0.00 H new ATOM 0 HE3 LYS A 720 -19.242 8.505 0.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 720 -18.565 10.327 1.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 720 -20.039 10.700 0.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 720 -20.017 10.233 2.549 1.00 0.00 H new ATOM 89 N GLU A 721 -20.077 3.038 -0.475 1.00 0.00 N ATOM 90 CA GLU A 721 -19.282 2.105 0.318 1.00 0.00 C ATOM 91 C GLU A 721 -19.619 0.667 -0.061 1.00 0.00 C ATOM 92 O GLU A 721 -20.645 0.119 0.344 1.00 0.00 O ATOM 93 CB GLU A 721 -19.518 2.333 1.813 1.00 0.00 C ATOM 94 CG GLU A 721 -18.785 1.346 2.706 1.00 0.00 C ATOM 95 CD GLU A 721 -18.966 1.650 4.180 1.00 0.00 C ATOM 96 OE1 GLU A 721 -20.080 1.424 4.700 1.00 0.00 O ATOM 97 OE2 GLU A 721 -17.997 2.116 4.814 1.00 0.00 O ATOM 0 H GLU A 721 -20.755 2.590 -1.091 1.00 0.00 H new ATOM 0 HA GLU A 721 -18.228 2.283 0.106 1.00 0.00 H new ATOM 0 HB2 GLU A 721 -19.204 3.345 2.071 1.00 0.00 H new ATOM 0 HB3 GLU A 721 -20.587 2.269 2.017 1.00 0.00 H new ATOM 0 HG2 GLU A 721 -19.145 0.338 2.500 1.00 0.00 H new ATOM 0 HG3 GLU A 721 -17.723 1.361 2.463 1.00 0.00 H new ATOM 104 N PRO A 722 -18.733 0.050 -0.855 1.00 0.00 N ATOM 105 CA PRO A 722 -18.890 -1.320 -1.332 1.00 0.00 C ATOM 106 C PRO A 722 -19.102 -2.323 -0.197 1.00 0.00 C ATOM 107 O PRO A 722 -20.208 -2.832 -0.021 1.00 0.00 O ATOM 108 CB PRO A 722 -17.600 -1.606 -2.097 1.00 0.00 C ATOM 109 CG PRO A 722 -16.703 -0.451 -1.875 1.00 0.00 C ATOM 110 CD PRO A 722 -17.510 0.673 -1.352 1.00 0.00 C ATOM 0 HA PRO A 722 -19.780 -1.425 -1.953 1.00 0.00 H new ATOM 0 HB2 PRO A 722 -17.138 -2.527 -1.743 1.00 0.00 H new ATOM 0 HB3 PRO A 722 -17.803 -1.739 -3.160 1.00 0.00 H new ATOM 0 HG2 PRO A 722 -15.915 -0.713 -1.169 1.00 0.00 H new ATOM 0 HG3 PRO A 722 -16.214 -0.166 -2.807 1.00 0.00 H new ATOM 0 HD2 PRO A 722 -16.984 1.202 -0.558 1.00 0.00 H new ATOM 0 HD3 PRO A 722 -17.726 1.403 -2.133 1.00 0.00 H new ATOM 118 N ARG A 723 -18.041 -2.592 0.568 1.00 0.00 N ATOM 119 CA ARG A 723 -18.098 -3.532 1.696 1.00 0.00 C ATOM 120 C ARG A 723 -18.176 -4.985 1.228 1.00 0.00 C ATOM 121 O ARG A 723 -17.445 -5.842 1.726 1.00 0.00 O ATOM 122 CB ARG A 723 -19.274 -3.219 2.620 1.00 0.00 C ATOM 123 CG ARG A 723 -19.231 -4.009 3.914 1.00 0.00 C ATOM 124 CD ARG A 723 -18.310 -3.363 4.936 1.00 0.00 C ATOM 125 NE ARG A 723 -18.806 -2.063 5.379 1.00 0.00 N ATOM 126 CZ ARG A 723 -18.568 -1.557 6.585 1.00 0.00 C ATOM 127 NH1 ARG A 723 -17.851 -2.242 7.466 1.00 0.00 N ATOM 128 NH2 ARG A 723 -19.050 -0.366 6.914 1.00 0.00 N ATOM 0 H ARG A 723 -17.124 -2.169 0.427 1.00 0.00 H new ATOM 0 HA ARG A 723 -17.170 -3.406 2.253 1.00 0.00 H new ATOM 0 HB2 ARG A 723 -19.276 -2.154 2.850 1.00 0.00 H new ATOM 0 HB3 ARG A 723 -20.207 -3.434 2.099 1.00 0.00 H new ATOM 0 HG2 ARG A 723 -20.237 -4.086 4.327 1.00 0.00 H new ATOM 0 HG3 ARG A 723 -18.892 -5.025 3.709 1.00 0.00 H new ATOM 0 HD2 ARG A 723 -18.205 -4.023 5.797 1.00 0.00 H new ATOM 0 HD3 ARG A 723 -17.317 -3.243 4.503 1.00 0.00 H new ATOM 0 HE ARG A 723 -19.366 -1.513 4.727 1.00 0.00 H new ATOM 0 HH11 ARG A 723 -17.481 -3.160 7.219 1.00 0.00 H new ATOM 0 HH12 ARG A 723 -17.670 -1.851 8.391 1.00 0.00 H new ATOM 0 HH21 ARG A 723 -19.604 0.163 6.241 1.00 0.00 H new ATOM 0 HH22 ARG A 723 -18.866 0.021 7.840 1.00 0.00 H new ATOM 142 N ASP A 724 -19.068 -5.266 0.285 1.00 0.00 N ATOM 143 CA ASP A 724 -19.221 -6.618 -0.238 1.00 0.00 C ATOM 144 C ASP A 724 -17.942 -7.078 -0.914 1.00 0.00 C ATOM 145 O ASP A 724 -17.272 -6.313 -1.594 1.00 0.00 O ATOM 146 CB ASP A 724 -20.391 -6.678 -1.214 1.00 0.00 C ATOM 147 CG ASP A 724 -20.543 -8.028 -1.891 1.00 0.00 C ATOM 148 OD1 ASP A 724 -21.113 -8.945 -1.264 1.00 0.00 O ATOM 149 OD2 ASP A 724 -20.102 -8.164 -3.049 1.00 0.00 O ATOM 0 H ASP A 724 -19.695 -4.578 -0.132 1.00 0.00 H new ATOM 0 HA ASP A 724 -19.428 -7.289 0.596 1.00 0.00 H new ATOM 0 HB2 ASP A 724 -21.312 -6.442 -0.681 1.00 0.00 H new ATOM 0 HB3 ASP A 724 -20.258 -5.910 -1.976 1.00 0.00 H new ATOM 154 N PRO A 725 -17.590 -8.343 -0.697 1.00 0.00 N ATOM 155 CA PRO A 725 -16.390 -8.956 -1.254 1.00 0.00 C ATOM 156 C PRO A 725 -16.295 -8.840 -2.772 1.00 0.00 C ATOM 157 O PRO A 725 -15.199 -8.817 -3.324 1.00 0.00 O ATOM 158 CB PRO A 725 -16.496 -10.429 -0.836 1.00 0.00 C ATOM 159 CG PRO A 725 -17.878 -10.607 -0.310 1.00 0.00 C ATOM 160 CD PRO A 725 -18.340 -9.265 0.143 1.00 0.00 C ATOM 0 HA PRO A 725 -15.494 -8.456 -0.886 1.00 0.00 H new ATOM 0 HB2 PRO A 725 -16.313 -11.089 -1.684 1.00 0.00 H new ATOM 0 HB3 PRO A 725 -15.754 -10.673 -0.075 1.00 0.00 H new ATOM 0 HG2 PRO A 725 -18.538 -11.003 -1.082 1.00 0.00 H new ATOM 0 HG3 PRO A 725 -17.889 -11.319 0.515 1.00 0.00 H new ATOM 0 HD2 PRO A 725 -19.415 -9.145 0.009 1.00 0.00 H new ATOM 0 HD3 PRO A 725 -18.130 -9.105 1.201 1.00 0.00 H new ATOM 168 N ASP A 726 -17.442 -8.769 -3.440 1.00 0.00 N ATOM 169 CA ASP A 726 -17.475 -8.649 -4.893 1.00 0.00 C ATOM 170 C ASP A 726 -17.535 -7.183 -5.268 1.00 0.00 C ATOM 171 O ASP A 726 -16.861 -6.733 -6.197 1.00 0.00 O ATOM 172 CB ASP A 726 -18.681 -9.395 -5.469 1.00 0.00 C ATOM 173 CG ASP A 726 -18.732 -10.843 -5.023 1.00 0.00 C ATOM 174 OD1 ASP A 726 -19.014 -11.088 -3.832 1.00 0.00 O ATOM 175 OD2 ASP A 726 -18.493 -11.732 -5.866 1.00 0.00 O ATOM 0 H ASP A 726 -18.361 -8.793 -2.998 1.00 0.00 H new ATOM 0 HA ASP A 726 -16.573 -9.096 -5.311 1.00 0.00 H new ATOM 0 HB2 ASP A 726 -19.597 -8.891 -5.162 1.00 0.00 H new ATOM 0 HB3 ASP A 726 -18.644 -9.354 -6.558 1.00 0.00 H new ATOM 180 N GLN A 727 -18.356 -6.443 -4.533 1.00 0.00 N ATOM 181 CA GLN A 727 -18.493 -5.017 -4.742 1.00 0.00 C ATOM 182 C GLN A 727 -17.125 -4.375 -4.608 1.00 0.00 C ATOM 183 O GLN A 727 -16.708 -3.588 -5.450 1.00 0.00 O ATOM 184 CB GLN A 727 -19.473 -4.437 -3.722 1.00 0.00 C ATOM 185 CG GLN A 727 -20.916 -4.779 -4.036 1.00 0.00 C ATOM 186 CD GLN A 727 -21.902 -4.014 -3.175 1.00 0.00 C ATOM 187 OE1 GLN A 727 -21.634 -2.890 -2.752 1.00 0.00 O ATOM 188 NE2 GLN A 727 -23.052 -4.624 -2.910 1.00 0.00 N ATOM 0 H GLN A 727 -18.939 -6.815 -3.783 1.00 0.00 H new ATOM 0 HA GLN A 727 -18.886 -4.815 -5.738 1.00 0.00 H new ATOM 0 HB2 GLN A 727 -19.223 -4.812 -2.730 1.00 0.00 H new ATOM 0 HB3 GLN A 727 -19.359 -3.353 -3.691 1.00 0.00 H new ATOM 0 HG2 GLN A 727 -21.115 -4.565 -5.086 1.00 0.00 H new ATOM 0 HG3 GLN A 727 -21.070 -5.849 -3.894 1.00 0.00 H new ATOM 0 HE21 GLN A 727 -23.232 -5.557 -3.282 1.00 0.00 H new ATOM 0 HE22 GLN A 727 -23.755 -4.160 -2.335 1.00 0.00 H new ATOM 197 N LEU A 728 -16.426 -4.768 -3.551 1.00 0.00 N ATOM 198 CA LEU A 728 -15.084 -4.289 -3.264 1.00 0.00 C ATOM 199 C LEU A 728 -14.115 -4.851 -4.269 1.00 0.00 C ATOM 200 O LEU A 728 -13.423 -4.113 -4.946 1.00 0.00 O ATOM 201 CB LEU A 728 -14.664 -4.738 -1.871 1.00 0.00 C ATOM 202 CG LEU A 728 -15.150 -3.863 -0.736 1.00 0.00 C ATOM 203 CD1 LEU A 728 -14.986 -4.574 0.594 1.00 0.00 C ATOM 204 CD2 LEU A 728 -14.360 -2.578 -0.749 1.00 0.00 C ATOM 0 H LEU A 728 -16.779 -5.434 -2.864 1.00 0.00 H new ATOM 0 HA LEU A 728 -15.080 -3.200 -3.318 1.00 0.00 H new ATOM 0 HB2 LEU A 728 -15.029 -5.752 -1.708 1.00 0.00 H new ATOM 0 HB3 LEU A 728 -13.576 -4.782 -1.834 1.00 0.00 H new ATOM 0 HG LEU A 728 -16.210 -3.646 -0.867 1.00 0.00 H new ATOM 0 HD11 LEU A 728 -15.341 -3.929 1.398 1.00 0.00 H new ATOM 0 HD12 LEU A 728 -15.566 -5.497 0.587 1.00 0.00 H new ATOM 0 HD13 LEU A 728 -13.933 -4.808 0.754 1.00 0.00 H new ATOM 0 HD21 LEU A 728 -14.698 -1.935 0.064 1.00 0.00 H new ATOM 0 HD22 LEU A 728 -13.301 -2.801 -0.619 1.00 0.00 H new ATOM 0 HD23 LEU A 728 -14.510 -2.069 -1.701 1.00 0.00 H new ATOM 216 N TYR A 729 -14.094 -6.165 -4.387 1.00 0.00 N ATOM 217 CA TYR A 729 -13.197 -6.813 -5.317 1.00 0.00 C ATOM 218 C TYR A 729 -13.029 -5.982 -6.563 1.00 0.00 C ATOM 219 O TYR A 729 -11.939 -5.494 -6.836 1.00 0.00 O ATOM 220 CB TYR A 729 -13.766 -8.175 -5.694 1.00 0.00 C ATOM 221 CG TYR A 729 -13.469 -8.592 -7.107 1.00 0.00 C ATOM 222 CD1 TYR A 729 -12.191 -8.899 -7.441 1.00 0.00 C ATOM 223 CD2 TYR A 729 -14.452 -8.683 -8.085 1.00 0.00 C ATOM 224 CE1 TYR A 729 -11.844 -9.290 -8.707 1.00 0.00 C ATOM 225 CE2 TYR A 729 -14.128 -9.075 -9.373 1.00 0.00 C ATOM 226 CZ TYR A 729 -12.817 -9.378 -9.681 1.00 0.00 C ATOM 227 OH TYR A 729 -12.481 -9.769 -10.957 1.00 0.00 O ATOM 0 H TYR A 729 -14.686 -6.800 -3.852 1.00 0.00 H new ATOM 0 HA TYR A 729 -12.223 -6.930 -4.842 1.00 0.00 H new ATOM 0 HB2 TYR A 729 -13.366 -8.926 -5.013 1.00 0.00 H new ATOM 0 HB3 TYR A 729 -14.846 -8.158 -5.550 1.00 0.00 H new ATOM 0 HD1 TYR A 729 -11.423 -8.833 -6.685 1.00 0.00 H new ATOM 0 HD2 TYR A 729 -15.477 -8.446 -7.839 1.00 0.00 H new ATOM 0 HE1 TYR A 729 -10.817 -9.528 -8.941 1.00 0.00 H new ATOM 0 HE2 TYR A 729 -14.895 -9.143 -10.130 1.00 0.00 H new ATOM 0 HH TYR A 729 -13.284 -9.779 -11.518 1.00 0.00 H new ATOM 237 N SER A 730 -14.101 -5.763 -7.290 1.00 0.00 N ATOM 238 CA SER A 730 -13.971 -5.004 -8.499 1.00 0.00 C ATOM 239 C SER A 730 -14.035 -3.505 -8.280 1.00 0.00 C ATOM 240 O SER A 730 -13.631 -2.739 -9.156 1.00 0.00 O ATOM 241 CB SER A 730 -14.867 -5.506 -9.601 1.00 0.00 C ATOM 242 OG SER A 730 -15.342 -4.446 -10.413 1.00 0.00 O ATOM 0 H SER A 730 -15.042 -6.090 -7.070 1.00 0.00 H new ATOM 0 HA SER A 730 -12.956 -5.179 -8.856 1.00 0.00 H new ATOM 0 HB2 SER A 730 -14.321 -6.220 -10.217 1.00 0.00 H new ATOM 0 HB3 SER A 730 -15.713 -6.040 -9.168 1.00 0.00 H new ATOM 0 HG SER A 730 -15.919 -4.807 -11.118 1.00 0.00 H new ATOM 248 N THR A 731 -14.545 -3.066 -7.130 1.00 0.00 N ATOM 249 CA THR A 731 -14.543 -1.640 -6.854 1.00 0.00 C ATOM 250 C THR A 731 -13.100 -1.272 -6.832 1.00 0.00 C ATOM 251 O THR A 731 -12.599 -0.498 -7.644 1.00 0.00 O ATOM 252 CB THR A 731 -15.170 -1.290 -5.488 1.00 0.00 C ATOM 253 OG1 THR A 731 -16.585 -1.111 -5.631 1.00 0.00 O ATOM 254 CG2 THR A 731 -14.555 -0.025 -4.897 1.00 0.00 C ATOM 0 H THR A 731 -14.949 -3.655 -6.402 1.00 0.00 H new ATOM 0 HA THR A 731 -15.132 -1.107 -7.600 1.00 0.00 H new ATOM 0 HB THR A 731 -14.968 -2.118 -4.808 1.00 0.00 H new ATOM 0 HG1 THR A 731 -17.034 -1.979 -5.558 1.00 0.00 H new ATOM 0 HG21 THR A 731 -15.021 0.191 -3.935 1.00 0.00 H new ATOM 0 HG22 THR A 731 -13.484 -0.172 -4.757 1.00 0.00 H new ATOM 0 HG23 THR A 731 -14.720 0.811 -5.576 1.00 0.00 H new ATOM 262 N LEU A 732 -12.456 -1.923 -5.898 1.00 0.00 N ATOM 263 CA LEU A 732 -11.051 -1.827 -5.678 1.00 0.00 C ATOM 264 C LEU A 732 -10.302 -2.201 -6.947 1.00 0.00 C ATOM 265 O LEU A 732 -9.231 -1.672 -7.221 1.00 0.00 O ATOM 266 CB LEU A 732 -10.680 -2.785 -4.571 1.00 0.00 C ATOM 267 CG LEU A 732 -11.591 -2.824 -3.349 1.00 0.00 C ATOM 268 CD1 LEU A 732 -11.455 -4.158 -2.680 1.00 0.00 C ATOM 269 CD2 LEU A 732 -11.235 -1.732 -2.380 1.00 0.00 C ATOM 0 H LEU A 732 -12.922 -2.557 -5.249 1.00 0.00 H new ATOM 0 HA LEU A 732 -10.785 -0.807 -5.402 1.00 0.00 H new ATOM 0 HB2 LEU A 732 -10.638 -3.789 -4.993 1.00 0.00 H new ATOM 0 HB3 LEU A 732 -9.673 -2.538 -4.234 1.00 0.00 H new ATOM 0 HG LEU A 732 -12.621 -2.670 -3.672 1.00 0.00 H new ATOM 0 HD11 LEU A 732 -12.104 -4.194 -1.805 1.00 0.00 H new ATOM 0 HD12 LEU A 732 -11.742 -4.945 -3.377 1.00 0.00 H new ATOM 0 HD13 LEU A 732 -10.420 -4.306 -2.371 1.00 0.00 H new ATOM 0 HD21 LEU A 732 -11.899 -1.781 -1.517 1.00 0.00 H new ATOM 0 HD22 LEU A 732 -10.203 -1.859 -2.052 1.00 0.00 H new ATOM 0 HD23 LEU A 732 -11.344 -0.763 -2.867 1.00 0.00 H new ATOM 281 N LYS A 733 -10.872 -3.127 -7.725 1.00 0.00 N ATOM 282 CA LYS A 733 -10.240 -3.548 -8.971 1.00 0.00 C ATOM 283 C LYS A 733 -10.005 -2.327 -9.826 1.00 0.00 C ATOM 284 O LYS A 733 -9.074 -2.275 -10.615 1.00 0.00 O ATOM 285 CB LYS A 733 -11.106 -4.569 -9.718 1.00 0.00 C ATOM 286 CG LYS A 733 -10.502 -5.089 -11.008 1.00 0.00 C ATOM 287 CD LYS A 733 -10.934 -6.519 -11.296 1.00 0.00 C ATOM 288 CE LYS A 733 -12.392 -6.610 -11.693 1.00 0.00 C ATOM 289 NZ LYS A 733 -12.898 -5.340 -12.285 1.00 0.00 N ATOM 0 H LYS A 733 -11.756 -3.591 -7.515 1.00 0.00 H new ATOM 0 HA LYS A 733 -9.291 -4.034 -8.746 1.00 0.00 H new ATOM 0 HB2 LYS A 733 -11.299 -5.414 -9.057 1.00 0.00 H new ATOM 0 HB3 LYS A 733 -12.070 -4.112 -9.942 1.00 0.00 H new ATOM 0 HG2 LYS A 733 -10.801 -4.445 -11.835 1.00 0.00 H new ATOM 0 HG3 LYS A 733 -9.415 -5.043 -10.945 1.00 0.00 H new ATOM 0 HD2 LYS A 733 -10.316 -6.929 -12.095 1.00 0.00 H new ATOM 0 HD3 LYS A 733 -10.761 -7.133 -10.412 1.00 0.00 H new ATOM 0 HE2 LYS A 733 -12.521 -7.420 -12.411 1.00 0.00 H new ATOM 0 HE3 LYS A 733 -12.989 -6.863 -10.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 -13.802 -5.518 -12.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 -13.040 -4.638 -11.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 -12.205 -4.976 -12.970 1.00 0.00 H new ATOM 303 N SER A 734 -10.844 -1.326 -9.612 1.00 0.00 N ATOM 304 CA SER A 734 -10.751 -0.076 -10.353 1.00 0.00 C ATOM 305 C SER A 734 -9.784 0.856 -9.653 1.00 0.00 C ATOM 306 O SER A 734 -8.893 1.409 -10.295 1.00 0.00 O ATOM 307 CB SER A 734 -12.125 0.582 -10.491 1.00 0.00 C ATOM 308 OG SER A 734 -13.047 -0.288 -11.124 1.00 0.00 O ATOM 0 H SER A 734 -11.601 -1.354 -8.928 1.00 0.00 H new ATOM 0 HA SER A 734 -10.382 -0.289 -11.356 1.00 0.00 H new ATOM 0 HB2 SER A 734 -12.499 0.859 -9.505 1.00 0.00 H new ATOM 0 HB3 SER A 734 -12.034 1.503 -11.068 1.00 0.00 H new ATOM 0 HG SER A 734 -13.237 -1.048 -10.535 1.00 0.00 H new ATOM 314 N ILE A 735 -9.963 1.051 -8.340 1.00 0.00 N ATOM 315 CA ILE A 735 -9.039 1.889 -7.607 1.00 0.00 C ATOM 316 C ILE A 735 -7.644 1.396 -7.916 1.00 0.00 C ATOM 317 O ILE A 735 -6.871 2.091 -8.553 1.00 0.00 O ATOM 318 CB ILE A 735 -9.294 1.885 -6.086 1.00 0.00 C ATOM 319 CG1 ILE A 735 -10.689 2.424 -5.833 1.00 0.00 C ATOM 320 CG2 ILE A 735 -8.266 2.766 -5.373 1.00 0.00 C ATOM 321 CD1 ILE A 735 -11.749 1.381 -5.844 1.00 0.00 C ATOM 0 H ILE A 735 -10.720 0.648 -7.787 1.00 0.00 H new ATOM 0 HA ILE A 735 -9.175 2.924 -7.921 1.00 0.00 H new ATOM 0 HB ILE A 735 -9.204 0.869 -5.701 1.00 0.00 H new ATOM 0 HG12 ILE A 735 -10.702 2.932 -4.868 1.00 0.00 H new ATOM 0 HG13 ILE A 735 -10.922 3.173 -6.590 1.00 0.00 H new ATOM 0 HG21 ILE A 735 -8.458 2.754 -4.300 1.00 0.00 H new ATOM 0 HG22 ILE A 735 -7.263 2.385 -5.566 1.00 0.00 H new ATOM 0 HG23 ILE A 735 -8.343 3.788 -5.744 1.00 0.00 H new ATOM 0 HD11 ILE A 735 -12.717 1.844 -5.656 1.00 0.00 H new ATOM 0 HD12 ILE A 735 -11.765 0.889 -6.816 1.00 0.00 H new ATOM 0 HD13 ILE A 735 -11.542 0.644 -5.068 1.00 0.00 H new ATOM 333 N LEU A 736 -7.369 0.157 -7.526 1.00 0.00 N ATOM 334 CA LEU A 736 -6.083 -0.471 -7.796 1.00 0.00 C ATOM 335 C LEU A 736 -5.637 -0.156 -9.204 1.00 0.00 C ATOM 336 O LEU A 736 -4.565 0.395 -9.431 1.00 0.00 O ATOM 337 CB LEU A 736 -6.197 -1.987 -7.654 1.00 0.00 C ATOM 338 CG LEU A 736 -5.159 -2.617 -6.756 1.00 0.00 C ATOM 339 CD1 LEU A 736 -5.419 -4.086 -6.705 1.00 0.00 C ATOM 340 CD2 LEU A 736 -3.762 -2.288 -7.214 1.00 0.00 C ATOM 0 H LEU A 736 -8.025 -0.436 -7.018 1.00 0.00 H new ATOM 0 HA LEU A 736 -5.358 -0.084 -7.080 1.00 0.00 H new ATOM 0 HB2 LEU A 736 -7.187 -2.229 -7.267 1.00 0.00 H new ATOM 0 HB3 LEU A 736 -6.123 -2.437 -8.644 1.00 0.00 H new ATOM 0 HG LEU A 736 -5.236 -2.210 -5.748 1.00 0.00 H new ATOM 0 HD11 LEU A 736 -4.681 -4.564 -6.061 1.00 0.00 H new ATOM 0 HD12 LEU A 736 -6.418 -4.265 -6.307 1.00 0.00 H new ATOM 0 HD13 LEU A 736 -5.349 -4.503 -7.710 1.00 0.00 H new ATOM 0 HD21 LEU A 736 -3.040 -2.757 -6.546 1.00 0.00 H new ATOM 0 HD22 LEU A 736 -3.614 -2.661 -8.227 1.00 0.00 H new ATOM 0 HD23 LEU A 736 -3.620 -1.207 -7.201 1.00 0.00 H new ATOM 352 N GLN A 737 -6.483 -0.539 -10.143 1.00 0.00 N ATOM 353 CA GLN A 737 -6.235 -0.307 -11.553 1.00 0.00 C ATOM 354 C GLN A 737 -5.779 1.123 -11.804 1.00 0.00 C ATOM 355 O GLN A 737 -4.910 1.373 -12.636 1.00 0.00 O ATOM 356 CB GLN A 737 -7.510 -0.621 -12.342 1.00 0.00 C ATOM 357 CG GLN A 737 -7.546 -2.030 -12.898 1.00 0.00 C ATOM 358 CD GLN A 737 -8.682 -2.248 -13.877 1.00 0.00 C ATOM 359 OE1 GLN A 737 -9.737 -1.623 -13.772 1.00 0.00 O ATOM 360 NE2 GLN A 737 -8.469 -3.139 -14.839 1.00 0.00 N ATOM 0 H GLN A 737 -7.361 -1.020 -9.949 1.00 0.00 H new ATOM 0 HA GLN A 737 -5.431 -0.963 -11.887 1.00 0.00 H new ATOM 0 HB2 GLN A 737 -8.374 -0.472 -11.694 1.00 0.00 H new ATOM 0 HB3 GLN A 737 -7.602 0.088 -13.165 1.00 0.00 H new ATOM 0 HG2 GLN A 737 -6.599 -2.244 -13.394 1.00 0.00 H new ATOM 0 HG3 GLN A 737 -7.642 -2.738 -12.075 1.00 0.00 H new ATOM 0 HE21 GLN A 737 -7.578 -3.634 -14.888 1.00 0.00 H new ATOM 0 HE22 GLN A 737 -9.196 -3.328 -15.529 1.00 0.00 H new ATOM 369 N GLN A 738 -6.353 2.049 -11.058 1.00 0.00 N ATOM 370 CA GLN A 738 -6.029 3.460 -11.190 1.00 0.00 C ATOM 371 C GLN A 738 -4.725 3.813 -10.473 1.00 0.00 C ATOM 372 O GLN A 738 -3.771 4.281 -11.096 1.00 0.00 O ATOM 373 CB GLN A 738 -7.181 4.285 -10.629 1.00 0.00 C ATOM 374 CG GLN A 738 -8.431 4.191 -11.479 1.00 0.00 C ATOM 375 CD GLN A 738 -9.661 4.736 -10.779 1.00 0.00 C ATOM 376 OE1 GLN A 738 -10.573 5.258 -11.420 1.00 0.00 O ATOM 377 NE2 GLN A 738 -9.694 4.613 -9.457 1.00 0.00 N ATOM 0 H GLN A 738 -7.055 1.847 -10.346 1.00 0.00 H new ATOM 0 HA GLN A 738 -5.885 3.686 -12.247 1.00 0.00 H new ATOM 0 HB2 GLN A 738 -7.407 3.947 -9.618 1.00 0.00 H new ATOM 0 HB3 GLN A 738 -6.874 5.328 -10.555 1.00 0.00 H new ATOM 0 HG2 GLN A 738 -8.275 4.739 -12.408 1.00 0.00 H new ATOM 0 HG3 GLN A 738 -8.604 3.149 -11.749 1.00 0.00 H new ATOM 0 HE21 GLN A 738 -8.915 4.173 -8.966 1.00 0.00 H new ATOM 0 HE22 GLN A 738 -10.498 4.958 -8.933 1.00 0.00 H new ATOM 386 N VAL A 739 -4.701 3.594 -9.163 1.00 0.00 N ATOM 387 CA VAL A 739 -3.541 3.874 -8.342 1.00 0.00 C ATOM 388 C VAL A 739 -2.295 3.261 -8.946 1.00 0.00 C ATOM 389 O VAL A 739 -1.217 3.824 -8.845 1.00 0.00 O ATOM 390 CB VAL A 739 -3.712 3.318 -6.903 1.00 0.00 C ATOM 391 CG1 VAL A 739 -5.150 3.013 -6.564 1.00 0.00 C ATOM 392 CG2 VAL A 739 -2.836 2.108 -6.700 1.00 0.00 C ATOM 0 H VAL A 739 -5.493 3.215 -8.643 1.00 0.00 H new ATOM 0 HA VAL A 739 -3.441 4.959 -8.298 1.00 0.00 H new ATOM 0 HB VAL A 739 -3.395 4.102 -6.215 1.00 0.00 H new ATOM 0 HG11 VAL A 739 -5.210 2.627 -5.546 1.00 0.00 H new ATOM 0 HG12 VAL A 739 -5.743 3.924 -6.642 1.00 0.00 H new ATOM 0 HG13 VAL A 739 -5.537 2.267 -7.258 1.00 0.00 H new ATOM 0 HG21 VAL A 739 -2.967 1.730 -5.686 1.00 0.00 H new ATOM 0 HG22 VAL A 739 -3.114 1.334 -7.415 1.00 0.00 H new ATOM 0 HG23 VAL A 739 -1.793 2.385 -6.852 1.00 0.00 H new ATOM 402 N LYS A 740 -2.447 2.093 -9.550 1.00 0.00 N ATOM 403 CA LYS A 740 -1.317 1.413 -10.139 1.00 0.00 C ATOM 404 C LYS A 740 -1.033 1.934 -11.525 1.00 0.00 C ATOM 405 O LYS A 740 0.109 1.930 -11.975 1.00 0.00 O ATOM 406 CB LYS A 740 -1.512 -0.078 -10.142 1.00 0.00 C ATOM 407 CG LYS A 740 -1.989 -0.650 -11.431 1.00 0.00 C ATOM 408 CD LYS A 740 -3.078 -1.696 -11.245 1.00 0.00 C ATOM 409 CE LYS A 740 -2.521 -3.110 -11.284 1.00 0.00 C ATOM 410 NZ LYS A 740 -1.580 -3.308 -12.421 1.00 0.00 N ATOM 0 H LYS A 740 -3.337 1.603 -9.642 1.00 0.00 H new ATOM 0 HA LYS A 740 -0.445 1.624 -9.520 1.00 0.00 H new ATOM 0 HB2 LYS A 740 -0.567 -0.553 -9.879 1.00 0.00 H new ATOM 0 HB3 LYS A 740 -2.227 -0.337 -9.361 1.00 0.00 H new ATOM 0 HG2 LYS A 740 -2.368 0.154 -12.062 1.00 0.00 H new ATOM 0 HG3 LYS A 740 -1.147 -1.099 -11.958 1.00 0.00 H new ATOM 0 HD2 LYS A 740 -3.581 -1.530 -10.292 1.00 0.00 H new ATOM 0 HD3 LYS A 740 -3.829 -1.580 -12.026 1.00 0.00 H new ATOM 0 HE2 LYS A 740 -2.007 -3.323 -10.347 1.00 0.00 H new ATOM 0 HE3 LYS A 740 -3.343 -3.821 -11.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 740 -1.540 -4.318 -12.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 740 -1.911 -2.765 -13.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 740 -0.632 -2.980 -12.148 1.00 0.00 H new ATOM 424 N SER A 741 -2.075 2.358 -12.218 1.00 0.00 N ATOM 425 CA SER A 741 -1.882 2.918 -13.530 1.00 0.00 C ATOM 426 C SER A 741 -1.291 4.306 -13.368 1.00 0.00 C ATOM 427 O SER A 741 -0.868 4.948 -14.330 1.00 0.00 O ATOM 428 CB SER A 741 -3.196 2.992 -14.297 1.00 0.00 C ATOM 429 OG SER A 741 -2.974 3.257 -15.672 1.00 0.00 O ATOM 0 H SER A 741 -3.042 2.324 -11.897 1.00 0.00 H new ATOM 0 HA SER A 741 -1.208 2.280 -14.102 1.00 0.00 H new ATOM 0 HB2 SER A 741 -3.737 2.052 -14.188 1.00 0.00 H new ATOM 0 HB3 SER A 741 -3.825 3.773 -13.871 1.00 0.00 H new ATOM 0 HG SER A 741 -2.285 3.948 -15.765 1.00 0.00 H new ATOM 435 N HIS A 742 -1.275 4.748 -12.113 1.00 0.00 N ATOM 436 CA HIS A 742 -0.755 6.051 -11.745 1.00 0.00 C ATOM 437 C HIS A 742 0.714 6.192 -12.149 1.00 0.00 C ATOM 438 O HIS A 742 1.493 5.248 -12.064 1.00 0.00 O ATOM 439 CB HIS A 742 -0.922 6.263 -10.227 1.00 0.00 C ATOM 440 CG HIS A 742 -0.537 7.630 -9.753 1.00 0.00 C ATOM 441 ND1 HIS A 742 0.431 8.401 -10.354 1.00 0.00 N ATOM 442 CD2 HIS A 742 -1.010 8.368 -8.732 1.00 0.00 C ATOM 443 CE1 HIS A 742 0.535 9.548 -9.729 1.00 0.00 C ATOM 444 NE2 HIS A 742 -0.330 9.561 -8.737 1.00 0.00 N ATOM 0 H HIS A 742 -1.625 4.206 -11.323 1.00 0.00 H new ATOM 0 HA HIS A 742 -1.319 6.816 -12.279 1.00 0.00 H new ATOM 0 HB2 HIS A 742 -1.962 6.076 -9.957 1.00 0.00 H new ATOM 0 HB3 HIS A 742 -0.318 5.524 -9.700 1.00 0.00 H new ATOM 0 HD2 HIS A 742 -1.783 8.076 -8.036 1.00 0.00 H new ATOM 0 HE1 HIS A 742 1.215 10.347 -9.984 1.00 0.00 H new ATOM 0 HE2 HIS A 742 -0.472 10.329 -8.081 1.00 0.00 H new ATOM 453 N GLN A 743 1.062 7.384 -12.614 1.00 0.00 N ATOM 454 CA GLN A 743 2.416 7.717 -13.022 1.00 0.00 C ATOM 455 C GLN A 743 3.410 7.604 -11.851 1.00 0.00 C ATOM 456 O GLN A 743 4.622 7.708 -12.039 1.00 0.00 O ATOM 457 CB GLN A 743 2.396 9.128 -13.595 1.00 0.00 C ATOM 458 CG GLN A 743 3.731 9.816 -13.529 1.00 0.00 C ATOM 459 CD GLN A 743 3.733 11.178 -14.191 1.00 0.00 C ATOM 460 OE1 GLN A 743 3.414 12.188 -13.564 1.00 0.00 O ATOM 461 NE2 GLN A 743 4.105 11.213 -15.465 1.00 0.00 N ATOM 0 H GLN A 743 0.402 8.155 -12.719 1.00 0.00 H new ATOM 0 HA GLN A 743 2.756 7.008 -13.777 1.00 0.00 H new ATOM 0 HB2 GLN A 743 2.068 9.086 -14.634 1.00 0.00 H new ATOM 0 HB3 GLN A 743 1.661 9.723 -13.052 1.00 0.00 H new ATOM 0 HG2 GLN A 743 4.025 9.926 -12.485 1.00 0.00 H new ATOM 0 HG3 GLN A 743 4.481 9.186 -14.006 1.00 0.00 H new ATOM 0 HE21 GLN A 743 4.361 10.350 -15.945 1.00 0.00 H new ATOM 0 HE22 GLN A 743 4.135 12.102 -15.963 1.00 0.00 H new ATOM 470 N SER A 744 2.892 7.373 -10.650 1.00 0.00 N ATOM 471 CA SER A 744 3.705 7.242 -9.461 1.00 0.00 C ATOM 472 C SER A 744 3.644 5.823 -8.962 1.00 0.00 C ATOM 473 O SER A 744 4.134 5.492 -7.883 1.00 0.00 O ATOM 474 CB SER A 744 3.184 8.191 -8.377 1.00 0.00 C ATOM 475 OG SER A 744 3.748 9.484 -8.512 1.00 0.00 O ATOM 0 H SER A 744 1.891 7.272 -10.480 1.00 0.00 H new ATOM 0 HA SER A 744 4.738 7.497 -9.699 1.00 0.00 H new ATOM 0 HB2 SER A 744 2.098 8.257 -8.440 1.00 0.00 H new ATOM 0 HB3 SER A 744 3.423 7.788 -7.393 1.00 0.00 H new ATOM 0 HG SER A 744 3.387 9.916 -9.314 1.00 0.00 H new ATOM 481 N ALA A 745 3.031 4.994 -9.769 1.00 0.00 N ATOM 482 CA ALA A 745 2.830 3.612 -9.432 1.00 0.00 C ATOM 483 C ALA A 745 3.794 2.653 -10.113 1.00 0.00 C ATOM 484 O ALA A 745 3.695 1.458 -9.893 1.00 0.00 O ATOM 485 CB ALA A 745 1.407 3.252 -9.795 1.00 0.00 C ATOM 0 H ALA A 745 2.657 5.262 -10.680 1.00 0.00 H new ATOM 0 HA ALA A 745 3.024 3.504 -8.365 1.00 0.00 H new ATOM 0 HB1 ALA A 745 1.223 2.206 -9.551 1.00 0.00 H new ATOM 0 HB2 ALA A 745 0.718 3.883 -9.234 1.00 0.00 H new ATOM 0 HB3 ALA A 745 1.253 3.408 -10.863 1.00 0.00 H new ATOM 491 N TRP A 746 4.722 3.136 -10.924 1.00 0.00 N ATOM 492 CA TRP A 746 5.628 2.218 -11.610 1.00 0.00 C ATOM 493 C TRP A 746 6.567 1.452 -10.660 1.00 0.00 C ATOM 494 O TRP A 746 6.896 0.300 -10.943 1.00 0.00 O ATOM 495 CB TRP A 746 6.410 2.913 -12.719 1.00 0.00 C ATOM 496 CG TRP A 746 6.965 4.247 -12.350 1.00 0.00 C ATOM 497 CD1 TRP A 746 6.351 5.455 -12.495 1.00 0.00 C ATOM 498 CD2 TRP A 746 8.247 4.510 -11.776 1.00 0.00 C ATOM 499 NE1 TRP A 746 7.186 6.460 -12.072 1.00 0.00 N ATOM 500 CE2 TRP A 746 8.353 5.903 -11.620 1.00 0.00 C ATOM 501 CE3 TRP A 746 9.316 3.700 -11.382 1.00 0.00 C ATOM 502 CZ2 TRP A 746 9.487 6.504 -11.091 1.00 0.00 C ATOM 503 CZ3 TRP A 746 10.439 4.299 -10.849 1.00 0.00 C ATOM 504 CH2 TRP A 746 10.516 5.688 -10.710 1.00 0.00 C ATOM 0 H TRP A 746 4.869 4.126 -11.122 1.00 0.00 H new ATOM 0 HA TRP A 746 4.985 1.467 -12.069 1.00 0.00 H new ATOM 0 HB2 TRP A 746 7.231 2.266 -13.026 1.00 0.00 H new ATOM 0 HB3 TRP A 746 5.758 3.033 -13.584 1.00 0.00 H new ATOM 0 HD1 TRP A 746 5.354 5.601 -12.885 1.00 0.00 H new ATOM 0 HE1 TRP A 746 6.972 7.457 -12.091 1.00 0.00 H new ATOM 0 HE3 TRP A 746 9.264 2.627 -11.493 1.00 0.00 H new ATOM 0 HZ2 TRP A 746 9.554 7.577 -10.984 1.00 0.00 H new ATOM 0 HZ3 TRP A 746 11.271 3.686 -10.535 1.00 0.00 H new ATOM 0 HH2 TRP A 746 11.410 6.127 -10.292 1.00 0.00 H new ATOM 515 N PRO A 747 7.023 2.041 -9.529 1.00 0.00 N ATOM 516 CA PRO A 747 7.887 1.323 -8.596 1.00 0.00 C ATOM 517 C PRO A 747 7.090 0.297 -7.818 1.00 0.00 C ATOM 518 O PRO A 747 7.643 -0.499 -7.049 1.00 0.00 O ATOM 519 CB PRO A 747 8.400 2.400 -7.637 1.00 0.00 C ATOM 520 CG PRO A 747 7.825 3.697 -8.081 1.00 0.00 C ATOM 521 CD PRO A 747 6.735 3.405 -9.059 1.00 0.00 C ATOM 0 HA PRO A 747 8.689 0.793 -9.110 1.00 0.00 H new ATOM 0 HB2 PRO A 747 8.100 2.177 -6.613 1.00 0.00 H new ATOM 0 HB3 PRO A 747 9.489 2.438 -7.649 1.00 0.00 H new ATOM 0 HG2 PRO A 747 7.434 4.253 -7.229 1.00 0.00 H new ATOM 0 HG3 PRO A 747 8.594 4.318 -8.541 1.00 0.00 H new ATOM 0 HD2 PRO A 747 5.753 3.465 -8.590 1.00 0.00 H new ATOM 0 HD3 PRO A 747 6.738 4.119 -9.883 1.00 0.00 H new ATOM 529 N PHE A 748 5.769 0.356 -8.008 1.00 0.00 N ATOM 530 CA PHE A 748 4.843 -0.521 -7.310 1.00 0.00 C ATOM 531 C PHE A 748 3.999 -1.340 -8.293 1.00 0.00 C ATOM 532 O PHE A 748 3.434 -2.365 -7.925 1.00 0.00 O ATOM 533 CB PHE A 748 3.926 0.303 -6.384 1.00 0.00 C ATOM 534 CG PHE A 748 4.505 1.597 -5.884 1.00 0.00 C ATOM 535 CD1 PHE A 748 5.844 1.727 -5.642 1.00 0.00 C ATOM 536 CD2 PHE A 748 3.700 2.690 -5.659 1.00 0.00 C ATOM 537 CE1 PHE A 748 6.383 2.910 -5.189 1.00 0.00 C ATOM 538 CE2 PHE A 748 4.245 3.873 -5.198 1.00 0.00 C ATOM 539 CZ PHE A 748 5.578 3.976 -4.968 1.00 0.00 C ATOM 0 H PHE A 748 5.320 1.011 -8.648 1.00 0.00 H new ATOM 0 HA PHE A 748 5.429 -1.217 -6.709 1.00 0.00 H new ATOM 0 HB2 PHE A 748 3.001 0.521 -6.918 1.00 0.00 H new ATOM 0 HB3 PHE A 748 3.660 -0.312 -5.524 1.00 0.00 H new ATOM 0 HD1 PHE A 748 6.495 0.882 -5.810 1.00 0.00 H new ATOM 0 HD2 PHE A 748 2.638 2.623 -5.843 1.00 0.00 H new ATOM 0 HE1 PHE A 748 7.445 2.988 -5.010 1.00 0.00 H new ATOM 0 HE2 PHE A 748 3.604 4.724 -5.019 1.00 0.00 H new ATOM 0 HZ PHE A 748 5.996 4.905 -4.610 1.00 0.00 H new ATOM 549 N MET A 749 3.938 -0.887 -9.551 1.00 0.00 N ATOM 550 CA MET A 749 3.127 -1.538 -10.592 1.00 0.00 C ATOM 551 C MET A 749 3.245 -3.041 -10.533 1.00 0.00 C ATOM 552 O MET A 749 2.291 -3.770 -10.805 1.00 0.00 O ATOM 553 CB MET A 749 3.529 -1.037 -11.970 1.00 0.00 C ATOM 554 CG MET A 749 2.656 0.105 -12.398 1.00 0.00 C ATOM 555 SD MET A 749 3.314 1.071 -13.754 1.00 0.00 S ATOM 556 CE MET A 749 2.664 2.639 -13.217 1.00 0.00 C ATOM 0 H MET A 749 4.445 -0.064 -9.877 1.00 0.00 H new ATOM 0 HA MET A 749 2.085 -1.277 -10.406 1.00 0.00 H new ATOM 0 HB2 MET A 749 4.571 -0.718 -11.956 1.00 0.00 H new ATOM 0 HB3 MET A 749 3.454 -1.849 -12.693 1.00 0.00 H new ATOM 0 HG2 MET A 749 1.681 -0.287 -12.687 1.00 0.00 H new ATOM 0 HG3 MET A 749 2.494 0.763 -11.544 1.00 0.00 H new ATOM 0 HE1 MET A 749 3.452 3.392 -13.255 1.00 0.00 H new ATOM 0 HE2 MET A 749 1.846 2.937 -13.872 1.00 0.00 H new ATOM 0 HE3 MET A 749 2.296 2.550 -12.195 1.00 0.00 H new ATOM 566 N GLU A 750 4.426 -3.489 -10.175 1.00 0.00 N ATOM 567 CA GLU A 750 4.708 -4.896 -10.062 1.00 0.00 C ATOM 568 C GLU A 750 5.783 -5.120 -9.013 1.00 0.00 C ATOM 569 O GLU A 750 6.516 -4.195 -8.663 1.00 0.00 O ATOM 570 CB GLU A 750 5.164 -5.437 -11.407 1.00 0.00 C ATOM 571 CG GLU A 750 4.024 -5.863 -12.314 1.00 0.00 C ATOM 572 CD GLU A 750 4.510 -6.448 -13.625 1.00 0.00 C ATOM 573 OE1 GLU A 750 4.909 -7.632 -13.635 1.00 0.00 O ATOM 574 OE2 GLU A 750 4.495 -5.723 -14.641 1.00 0.00 O ATOM 0 H GLU A 750 5.218 -2.885 -9.954 1.00 0.00 H new ATOM 0 HA GLU A 750 3.804 -5.424 -9.758 1.00 0.00 H new ATOM 0 HB2 GLU A 750 5.754 -4.673 -11.914 1.00 0.00 H new ATOM 0 HB3 GLU A 750 5.822 -6.290 -11.241 1.00 0.00 H new ATOM 0 HG2 GLU A 750 3.409 -6.600 -11.797 1.00 0.00 H new ATOM 0 HG3 GLU A 750 3.386 -5.003 -12.518 1.00 0.00 H new ATOM 581 N PRO A 751 5.897 -6.347 -8.495 1.00 0.00 N ATOM 582 CA PRO A 751 6.886 -6.675 -7.482 1.00 0.00 C ATOM 583 C PRO A 751 8.284 -6.652 -8.045 1.00 0.00 C ATOM 584 O PRO A 751 8.493 -6.855 -9.241 1.00 0.00 O ATOM 585 CB PRO A 751 6.510 -8.075 -7.024 1.00 0.00 C ATOM 586 CG PRO A 751 5.154 -8.299 -7.572 1.00 0.00 C ATOM 587 CD PRO A 751 5.095 -7.513 -8.843 1.00 0.00 C ATOM 0 HA PRO A 751 6.886 -5.953 -6.665 1.00 0.00 H new ATOM 0 HB2 PRO A 751 7.216 -8.817 -7.398 1.00 0.00 H new ATOM 0 HB3 PRO A 751 6.515 -8.150 -5.937 1.00 0.00 H new ATOM 0 HG2 PRO A 751 4.977 -9.358 -7.758 1.00 0.00 H new ATOM 0 HG3 PRO A 751 4.389 -7.967 -6.871 1.00 0.00 H new ATOM 0 HD2 PRO A 751 5.513 -8.063 -9.686 1.00 0.00 H new ATOM 0 HD3 PRO A 751 4.074 -7.244 -9.113 1.00 0.00 H new ATOM 595 N VAL A 752 9.236 -6.406 -7.175 1.00 0.00 N ATOM 596 CA VAL A 752 10.621 -6.338 -7.579 1.00 0.00 C ATOM 597 C VAL A 752 11.243 -7.732 -7.556 1.00 0.00 C ATOM 598 O VAL A 752 10.609 -8.697 -7.131 1.00 0.00 O ATOM 599 CB VAL A 752 11.398 -5.319 -6.706 1.00 0.00 C ATOM 600 CG1 VAL A 752 10.440 -4.533 -5.845 1.00 0.00 C ATOM 601 CG2 VAL A 752 12.481 -5.958 -5.848 1.00 0.00 C ATOM 0 H VAL A 752 9.076 -6.249 -6.180 1.00 0.00 H new ATOM 0 HA VAL A 752 10.681 -5.976 -8.605 1.00 0.00 H new ATOM 0 HB VAL A 752 11.910 -4.648 -7.395 1.00 0.00 H new ATOM 0 HG11 VAL A 752 10.998 -3.821 -5.237 1.00 0.00 H new ATOM 0 HG12 VAL A 752 9.737 -3.995 -6.481 1.00 0.00 H new ATOM 0 HG13 VAL A 752 9.892 -5.215 -5.195 1.00 0.00 H new ATOM 0 HG21 VAL A 752 12.984 -5.188 -5.264 1.00 0.00 H new ATOM 0 HG22 VAL A 752 12.029 -6.687 -5.175 1.00 0.00 H new ATOM 0 HG23 VAL A 752 13.206 -6.458 -6.490 1.00 0.00 H new ATOM 611 N LYS A 753 12.478 -7.825 -8.008 1.00 0.00 N ATOM 612 CA LYS A 753 13.177 -9.106 -8.097 1.00 0.00 C ATOM 613 C LYS A 753 13.596 -9.612 -6.735 1.00 0.00 C ATOM 614 O LYS A 753 14.383 -10.555 -6.639 1.00 0.00 O ATOM 615 CB LYS A 753 14.429 -8.946 -8.949 1.00 0.00 C ATOM 616 CG LYS A 753 14.143 -8.481 -10.360 1.00 0.00 C ATOM 617 CD LYS A 753 14.644 -9.472 -11.396 1.00 0.00 C ATOM 618 CE LYS A 753 14.258 -9.044 -12.801 1.00 0.00 C ATOM 619 NZ LYS A 753 14.774 -9.985 -13.833 1.00 0.00 N ATOM 0 H LYS A 753 13.028 -7.026 -8.323 1.00 0.00 H new ATOM 0 HA LYS A 753 12.488 -9.823 -8.543 1.00 0.00 H new ATOM 0 HB2 LYS A 753 15.097 -8.232 -8.468 1.00 0.00 H new ATOM 0 HB3 LYS A 753 14.956 -9.899 -8.989 1.00 0.00 H new ATOM 0 HG2 LYS A 753 13.070 -8.338 -10.484 1.00 0.00 H new ATOM 0 HG3 LYS A 753 14.615 -7.513 -10.526 1.00 0.00 H new ATOM 0 HD2 LYS A 753 15.728 -9.559 -11.325 1.00 0.00 H new ATOM 0 HD3 LYS A 753 14.231 -10.459 -11.188 1.00 0.00 H new ATOM 0 HE2 LYS A 753 13.172 -8.984 -12.876 1.00 0.00 H new ATOM 0 HE3 LYS A 753 14.647 -8.044 -12.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 753 14.488 -9.656 -14.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 753 15.812 -10.024 -13.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 753 14.383 -10.934 -13.664 1.00 0.00 H new ATOM 633 N ARG A 754 13.081 -8.989 -5.682 1.00 0.00 N ATOM 634 CA ARG A 754 13.475 -9.350 -4.333 1.00 0.00 C ATOM 635 C ARG A 754 14.951 -9.033 -4.183 1.00 0.00 C ATOM 636 O ARG A 754 15.541 -9.199 -3.115 1.00 0.00 O ATOM 637 CB ARG A 754 13.222 -10.835 -4.061 1.00 0.00 C ATOM 638 CG ARG A 754 13.152 -11.188 -2.585 1.00 0.00 C ATOM 639 CD ARG A 754 14.427 -11.869 -2.111 1.00 0.00 C ATOM 640 NE ARG A 754 14.732 -13.062 -2.896 1.00 0.00 N ATOM 641 CZ ARG A 754 15.522 -14.044 -2.471 1.00 0.00 C ATOM 642 NH1 ARG A 754 16.082 -13.979 -1.270 1.00 0.00 N ATOM 643 NH2 ARG A 754 15.751 -15.094 -3.247 1.00 0.00 N ATOM 0 H ARG A 754 12.394 -8.237 -5.739 1.00 0.00 H new ATOM 0 HA ARG A 754 12.884 -8.785 -3.613 1.00 0.00 H new ATOM 0 HB2 ARG A 754 12.287 -11.128 -4.539 1.00 0.00 H new ATOM 0 HB3 ARG A 754 14.015 -11.420 -4.527 1.00 0.00 H new ATOM 0 HG2 ARG A 754 12.984 -10.283 -2.001 1.00 0.00 H new ATOM 0 HG3 ARG A 754 12.300 -11.845 -2.407 1.00 0.00 H new ATOM 0 HD2 ARG A 754 15.259 -11.168 -2.178 1.00 0.00 H new ATOM 0 HD3 ARG A 754 14.324 -12.142 -1.061 1.00 0.00 H new ATOM 0 HE ARG A 754 14.315 -13.147 -3.823 1.00 0.00 H new ATOM 0 HH11 ARG A 754 15.907 -13.174 -0.669 1.00 0.00 H new ATOM 0 HH12 ARG A 754 16.687 -14.734 -0.948 1.00 0.00 H new ATOM 0 HH21 ARG A 754 15.321 -15.149 -4.170 1.00 0.00 H new ATOM 0 HH22 ARG A 754 16.357 -15.847 -2.921 1.00 0.00 H new ATOM 657 N THR A 755 15.536 -8.559 -5.287 1.00 0.00 N ATOM 658 CA THR A 755 16.937 -8.221 -5.331 1.00 0.00 C ATOM 659 C THR A 755 17.166 -6.925 -6.101 1.00 0.00 C ATOM 660 O THR A 755 18.237 -6.327 -5.989 1.00 0.00 O ATOM 661 CB THR A 755 17.777 -9.344 -5.949 1.00 0.00 C ATOM 662 OG1 THR A 755 17.552 -9.413 -7.362 1.00 0.00 O ATOM 663 CG2 THR A 755 17.432 -10.675 -5.305 1.00 0.00 C ATOM 0 H THR A 755 15.042 -8.404 -6.166 1.00 0.00 H new ATOM 0 HA THR A 755 17.259 -8.083 -4.299 1.00 0.00 H new ATOM 0 HB THR A 755 18.830 -9.127 -5.769 1.00 0.00 H new ATOM 0 HG1 THR A 755 18.095 -10.133 -7.745 1.00 0.00 H new ATOM 0 HG21 THR A 755 18.036 -11.464 -5.754 1.00 0.00 H new ATOM 0 HG22 THR A 755 17.636 -10.625 -4.235 1.00 0.00 H new ATOM 0 HG23 THR A 755 16.376 -10.893 -5.463 1.00 0.00 H new ATOM 671 N GLU A 756 16.171 -6.497 -6.904 1.00 0.00 N ATOM 672 CA GLU A 756 16.281 -5.222 -7.603 1.00 0.00 C ATOM 673 C GLU A 756 16.699 -4.269 -6.544 1.00 0.00 C ATOM 674 O GLU A 756 17.593 -3.433 -6.672 1.00 0.00 O ATOM 675 CB GLU A 756 14.938 -4.755 -8.089 1.00 0.00 C ATOM 676 CG GLU A 756 14.437 -5.432 -9.307 1.00 0.00 C ATOM 677 CD GLU A 756 15.277 -5.145 -10.537 1.00 0.00 C ATOM 678 OE1 GLU A 756 16.297 -5.837 -10.735 1.00 0.00 O ATOM 679 OE2 GLU A 756 14.914 -4.226 -11.301 1.00 0.00 O ATOM 0 H GLU A 756 15.306 -7.009 -7.076 1.00 0.00 H new ATOM 0 HA GLU A 756 16.956 -5.299 -8.456 1.00 0.00 H new ATOM 0 HB2 GLU A 756 14.211 -4.896 -7.289 1.00 0.00 H new ATOM 0 HB3 GLU A 756 14.993 -3.684 -8.285 1.00 0.00 H new ATOM 0 HG2 GLU A 756 14.414 -6.508 -9.134 1.00 0.00 H new ATOM 0 HG3 GLU A 756 13.410 -5.117 -9.494 1.00 0.00 H new ATOM 686 N ALA A 757 15.965 -4.474 -5.481 1.00 0.00 N ATOM 687 CA ALA A 757 16.111 -3.775 -4.246 1.00 0.00 C ATOM 688 C ALA A 757 16.978 -4.572 -3.307 1.00 0.00 C ATOM 689 O ALA A 757 16.611 -5.654 -2.854 1.00 0.00 O ATOM 690 CB ALA A 757 14.768 -3.561 -3.657 1.00 0.00 C ATOM 0 H ALA A 757 15.217 -5.167 -5.460 1.00 0.00 H new ATOM 0 HA ALA A 757 16.588 -2.810 -4.417 1.00 0.00 H new ATOM 0 HB1 ALA A 757 14.866 -3.027 -2.712 1.00 0.00 H new ATOM 0 HB2 ALA A 757 14.159 -2.974 -4.344 1.00 0.00 H new ATOM 0 HB3 ALA A 757 14.290 -4.525 -3.481 1.00 0.00 H new ATOM 696 N PRO A 758 18.153 -4.045 -3.029 1.00 0.00 N ATOM 697 CA PRO A 758 19.107 -4.677 -2.135 1.00 0.00 C ATOM 698 C PRO A 758 18.575 -4.694 -0.722 1.00 0.00 C ATOM 699 O PRO A 758 18.332 -3.645 -0.125 1.00 0.00 O ATOM 700 CB PRO A 758 20.334 -3.778 -2.253 1.00 0.00 C ATOM 701 CG PRO A 758 19.775 -2.462 -2.676 1.00 0.00 C ATOM 702 CD PRO A 758 18.634 -2.770 -3.559 1.00 0.00 C ATOM 0 HA PRO A 758 19.317 -5.717 -2.384 1.00 0.00 H new ATOM 0 HB2 PRO A 758 20.865 -3.700 -1.304 1.00 0.00 H new ATOM 0 HB3 PRO A 758 21.044 -4.164 -2.985 1.00 0.00 H new ATOM 0 HG2 PRO A 758 19.454 -1.879 -1.813 1.00 0.00 H new ATOM 0 HG3 PRO A 758 20.525 -1.870 -3.200 1.00 0.00 H new ATOM 0 HD2 PRO A 758 17.867 -1.997 -3.514 1.00 0.00 H new ATOM 0 HD3 PRO A 758 18.940 -2.854 -4.602 1.00 0.00 H new ATOM 710 N GLY A 759 18.392 -5.887 -0.189 1.00 0.00 N ATOM 711 CA GLY A 759 17.844 -6.002 1.134 1.00 0.00 C ATOM 712 C GLY A 759 16.388 -5.599 1.129 1.00 0.00 C ATOM 713 O GLY A 759 15.808 -5.341 2.175 1.00 0.00 O ATOM 0 H GLY A 759 18.612 -6.771 -0.648 1.00 0.00 H new ATOM 0 HA2 GLY A 759 17.944 -7.027 1.490 1.00 0.00 H new ATOM 0 HA3 GLY A 759 18.402 -5.369 1.824 1.00 0.00 H new ATOM 717 N TYR A 760 15.807 -5.527 -0.074 1.00 0.00 N ATOM 718 CA TYR A 760 14.406 -5.167 -0.248 1.00 0.00 C ATOM 719 C TYR A 760 13.536 -5.815 0.816 1.00 0.00 C ATOM 720 O TYR A 760 12.868 -5.134 1.582 1.00 0.00 O ATOM 721 CB TYR A 760 13.989 -5.623 -1.646 1.00 0.00 C ATOM 722 CG TYR A 760 12.544 -5.450 -2.017 1.00 0.00 C ATOM 723 CD1 TYR A 760 11.826 -4.355 -1.607 1.00 0.00 C ATOM 724 CD2 TYR A 760 11.912 -6.381 -2.817 1.00 0.00 C ATOM 725 CE1 TYR A 760 10.520 -4.187 -1.979 1.00 0.00 C ATOM 726 CE2 TYR A 760 10.598 -6.220 -3.194 1.00 0.00 C ATOM 727 CZ TYR A 760 9.906 -5.120 -2.773 1.00 0.00 C ATOM 728 OH TYR A 760 8.594 -4.947 -3.148 1.00 0.00 O ATOM 0 H TYR A 760 16.298 -5.717 -0.948 1.00 0.00 H new ATOM 0 HA TYR A 760 14.277 -4.090 -0.143 1.00 0.00 H new ATOM 0 HB2 TYR A 760 14.593 -5.080 -2.373 1.00 0.00 H new ATOM 0 HB3 TYR A 760 14.241 -6.679 -1.747 1.00 0.00 H new ATOM 0 HD1 TYR A 760 12.299 -3.614 -0.980 1.00 0.00 H new ATOM 0 HD2 TYR A 760 12.458 -7.250 -3.153 1.00 0.00 H new ATOM 0 HE1 TYR A 760 9.972 -3.318 -1.646 1.00 0.00 H new ATOM 0 HE2 TYR A 760 10.117 -6.958 -3.819 1.00 0.00 H new ATOM 0 HH TYR A 760 8.313 -5.698 -3.711 1.00 0.00 H new ATOM 738 N TYR A 761 13.566 -7.127 0.861 1.00 0.00 N ATOM 739 CA TYR A 761 12.781 -7.883 1.827 1.00 0.00 C ATOM 740 C TYR A 761 13.280 -7.694 3.253 1.00 0.00 C ATOM 741 O TYR A 761 12.570 -7.992 4.214 1.00 0.00 O ATOM 742 CB TYR A 761 12.771 -9.353 1.441 1.00 0.00 C ATOM 743 CG TYR A 761 11.704 -9.654 0.427 1.00 0.00 C ATOM 744 CD1 TYR A 761 11.490 -8.774 -0.615 1.00 0.00 C ATOM 745 CD2 TYR A 761 10.889 -10.774 0.526 1.00 0.00 C ATOM 746 CE1 TYR A 761 10.496 -8.992 -1.542 1.00 0.00 C ATOM 747 CE2 TYR A 761 9.892 -11.009 -0.404 1.00 0.00 C ATOM 748 CZ TYR A 761 9.699 -10.113 -1.437 1.00 0.00 C ATOM 749 OH TYR A 761 8.704 -10.337 -2.360 1.00 0.00 O ATOM 0 H TYR A 761 14.130 -7.703 0.236 1.00 0.00 H new ATOM 0 HA TYR A 761 11.761 -7.499 1.804 1.00 0.00 H new ATOM 0 HB2 TYR A 761 13.745 -9.630 1.038 1.00 0.00 H new ATOM 0 HB3 TYR A 761 12.610 -9.962 2.331 1.00 0.00 H new ATOM 0 HD1 TYR A 761 12.115 -7.898 -0.705 1.00 0.00 H new ATOM 0 HD2 TYR A 761 11.035 -11.470 1.339 1.00 0.00 H new ATOM 0 HE1 TYR A 761 10.341 -8.289 -2.347 1.00 0.00 H new ATOM 0 HE2 TYR A 761 9.269 -11.887 -0.323 1.00 0.00 H new ATOM 0 HH TYR A 761 8.237 -11.171 -2.142 1.00 0.00 H new ATOM 759 N GLU A 762 14.499 -7.200 3.385 1.00 0.00 N ATOM 760 CA GLU A 762 15.093 -6.970 4.696 1.00 0.00 C ATOM 761 C GLU A 762 14.431 -5.762 5.359 1.00 0.00 C ATOM 762 O GLU A 762 14.007 -5.819 6.513 1.00 0.00 O ATOM 763 CB GLU A 762 16.606 -6.755 4.558 1.00 0.00 C ATOM 764 CG GLU A 762 17.065 -5.364 4.950 1.00 0.00 C ATOM 765 CD GLU A 762 18.567 -5.264 5.123 1.00 0.00 C ATOM 766 OE1 GLU A 762 19.068 -5.642 6.203 1.00 0.00 O ATOM 767 OE2 GLU A 762 19.245 -4.809 4.177 1.00 0.00 O ATOM 0 H GLU A 762 15.100 -6.949 2.600 1.00 0.00 H new ATOM 0 HA GLU A 762 14.928 -7.845 5.325 1.00 0.00 H new ATOM 0 HB2 GLU A 762 17.125 -7.487 5.177 1.00 0.00 H new ATOM 0 HB3 GLU A 762 16.898 -6.946 3.525 1.00 0.00 H new ATOM 0 HG2 GLU A 762 16.744 -4.653 4.188 1.00 0.00 H new ATOM 0 HG3 GLU A 762 16.577 -5.075 5.881 1.00 0.00 H new ATOM 774 N VAL A 763 14.344 -4.678 4.601 1.00 0.00 N ATOM 775 CA VAL A 763 13.734 -3.445 5.057 1.00 0.00 C ATOM 776 C VAL A 763 12.252 -3.592 4.979 1.00 0.00 C ATOM 777 O VAL A 763 11.506 -3.222 5.888 1.00 0.00 O ATOM 778 CB VAL A 763 14.155 -2.237 4.168 1.00 0.00 C ATOM 779 CG1 VAL A 763 14.787 -2.672 2.881 1.00 0.00 C ATOM 780 CG2 VAL A 763 12.988 -1.394 3.763 1.00 0.00 C ATOM 0 H VAL A 763 14.699 -4.633 3.646 1.00 0.00 H new ATOM 0 HA VAL A 763 14.064 -3.256 6.079 1.00 0.00 H new ATOM 0 HB VAL A 763 14.854 -1.678 4.790 1.00 0.00 H new ATOM 0 HG11 VAL A 763 15.063 -1.794 2.296 1.00 0.00 H new ATOM 0 HG12 VAL A 763 15.679 -3.261 3.095 1.00 0.00 H new ATOM 0 HG13 VAL A 763 14.079 -3.277 2.315 1.00 0.00 H new ATOM 0 HG21 VAL A 763 13.335 -0.566 3.145 1.00 0.00 H new ATOM 0 HG22 VAL A 763 12.281 -1.999 3.195 1.00 0.00 H new ATOM 0 HG23 VAL A 763 12.496 -1.002 4.653 1.00 0.00 H new ATOM 790 N ILE A 764 11.843 -4.143 3.870 1.00 0.00 N ATOM 791 CA ILE A 764 10.462 -4.316 3.594 1.00 0.00 C ATOM 792 C ILE A 764 9.921 -5.640 4.090 1.00 0.00 C ATOM 793 O ILE A 764 9.950 -6.641 3.374 1.00 0.00 O ATOM 794 CB ILE A 764 10.199 -4.209 2.121 1.00 0.00 C ATOM 795 CG1 ILE A 764 10.928 -3.004 1.543 1.00 0.00 C ATOM 796 CG2 ILE A 764 8.725 -4.058 1.929 1.00 0.00 C ATOM 797 CD1 ILE A 764 10.161 -1.709 1.671 1.00 0.00 C ATOM 0 H ILE A 764 12.466 -4.482 3.137 1.00 0.00 H new ATOM 0 HA ILE A 764 9.947 -3.520 4.131 1.00 0.00 H new ATOM 0 HB ILE A 764 10.560 -5.100 1.607 1.00 0.00 H new ATOM 0 HG12 ILE A 764 11.889 -2.897 2.045 1.00 0.00 H new ATOM 0 HG13 ILE A 764 11.138 -3.189 0.489 1.00 0.00 H new ATOM 0 HG21 ILE A 764 8.503 -3.978 0.865 1.00 0.00 H new ATOM 0 HG22 ILE A 764 8.213 -4.927 2.342 1.00 0.00 H new ATOM 0 HG23 ILE A 764 8.382 -3.159 2.440 1.00 0.00 H new ATOM 0 HD11 ILE A 764 10.744 -0.896 1.237 1.00 0.00 H new ATOM 0 HD12 ILE A 764 9.211 -1.795 1.144 1.00 0.00 H new ATOM 0 HD13 ILE A 764 9.974 -1.499 2.724 1.00 0.00 H new ATOM 809 N ARG A 765 9.453 -5.651 5.323 1.00 0.00 N ATOM 810 CA ARG A 765 8.866 -6.850 5.894 1.00 0.00 C ATOM 811 C ARG A 765 7.717 -7.345 5.019 1.00 0.00 C ATOM 812 O ARG A 765 7.567 -8.546 4.795 1.00 0.00 O ATOM 813 CB ARG A 765 8.355 -6.570 7.297 1.00 0.00 C ATOM 814 CG ARG A 765 8.585 -7.704 8.279 1.00 0.00 C ATOM 815 CD ARG A 765 8.040 -9.018 7.762 1.00 0.00 C ATOM 816 NE ARG A 765 9.050 -9.793 7.046 1.00 0.00 N ATOM 817 CZ ARG A 765 8.816 -10.981 6.497 1.00 0.00 C ATOM 818 NH1 ARG A 765 7.612 -11.531 6.589 1.00 0.00 N ATOM 819 NH2 ARG A 765 9.786 -11.622 5.859 1.00 0.00 N ATOM 0 H ARG A 765 9.467 -4.845 5.948 1.00 0.00 H new ATOM 0 HA ARG A 765 9.635 -7.621 5.942 1.00 0.00 H new ATOM 0 HB2 ARG A 765 8.841 -5.671 7.676 1.00 0.00 H new ATOM 0 HB3 ARG A 765 7.287 -6.358 7.247 1.00 0.00 H new ATOM 0 HG2 ARG A 765 9.653 -7.805 8.473 1.00 0.00 H new ATOM 0 HG3 ARG A 765 8.110 -7.463 9.230 1.00 0.00 H new ATOM 0 HD2 ARG A 765 7.660 -9.605 8.598 1.00 0.00 H new ATOM 0 HD3 ARG A 765 7.197 -8.824 7.099 1.00 0.00 H new ATOM 0 HE ARG A 765 9.988 -9.401 6.962 1.00 0.00 H new ATOM 0 HH11 ARG A 765 6.864 -11.042 7.081 1.00 0.00 H new ATOM 0 HH12 ARG A 765 7.434 -12.443 6.167 1.00 0.00 H new ATOM 0 HH21 ARG A 765 10.714 -11.204 5.789 1.00 0.00 H new ATOM 0 HH22 ARG A 765 9.604 -12.533 5.438 1.00 0.00 H new ATOM 833 N PHE A 766 6.910 -6.408 4.523 1.00 0.00 N ATOM 834 CA PHE A 766 5.764 -6.757 3.680 1.00 0.00 C ATOM 835 C PHE A 766 5.769 -5.995 2.348 1.00 0.00 C ATOM 836 O PHE A 766 4.990 -5.061 2.159 1.00 0.00 O ATOM 837 CB PHE A 766 4.449 -6.471 4.414 1.00 0.00 C ATOM 838 CG PHE A 766 4.559 -6.364 5.906 1.00 0.00 C ATOM 839 CD1 PHE A 766 5.020 -7.423 6.652 1.00 0.00 C ATOM 840 CD2 PHE A 766 4.171 -5.209 6.559 1.00 0.00 C ATOM 841 CE1 PHE A 766 5.099 -7.336 8.029 1.00 0.00 C ATOM 842 CE2 PHE A 766 4.250 -5.108 7.928 1.00 0.00 C ATOM 843 CZ PHE A 766 4.713 -6.171 8.664 1.00 0.00 C ATOM 0 H PHE A 766 7.026 -5.408 4.688 1.00 0.00 H new ATOM 0 HA PHE A 766 5.848 -7.822 3.465 1.00 0.00 H new ATOM 0 HB2 PHE A 766 4.032 -5.540 4.029 1.00 0.00 H new ATOM 0 HB3 PHE A 766 3.738 -7.262 4.174 1.00 0.00 H new ATOM 0 HD1 PHE A 766 5.324 -8.333 6.156 1.00 0.00 H new ATOM 0 HD2 PHE A 766 3.800 -4.373 5.985 1.00 0.00 H new ATOM 0 HE1 PHE A 766 5.461 -8.174 8.606 1.00 0.00 H new ATOM 0 HE2 PHE A 766 3.949 -4.196 8.423 1.00 0.00 H new ATOM 0 HZ PHE A 766 4.775 -6.096 9.740 1.00 0.00 H new ATOM 853 N PRO A 767 6.651 -6.378 1.410 1.00 0.00 N ATOM 854 CA PRO A 767 6.740 -5.733 0.099 1.00 0.00 C ATOM 855 C PRO A 767 5.502 -5.925 -0.763 1.00 0.00 C ATOM 856 O PRO A 767 5.402 -6.878 -1.536 1.00 0.00 O ATOM 857 CB PRO A 767 7.982 -6.357 -0.545 1.00 0.00 C ATOM 858 CG PRO A 767 8.695 -7.041 0.550 1.00 0.00 C ATOM 859 CD PRO A 767 7.675 -7.405 1.580 1.00 0.00 C ATOM 0 HA PRO A 767 6.811 -4.650 0.201 1.00 0.00 H new ATOM 0 HB2 PRO A 767 7.705 -7.059 -1.331 1.00 0.00 H new ATOM 0 HB3 PRO A 767 8.610 -5.594 -1.006 1.00 0.00 H new ATOM 0 HG2 PRO A 767 9.204 -7.931 0.181 1.00 0.00 H new ATOM 0 HG3 PRO A 767 9.459 -6.391 0.977 1.00 0.00 H new ATOM 0 HD2 PRO A 767 7.274 -8.405 1.415 1.00 0.00 H new ATOM 0 HD3 PRO A 767 8.095 -7.392 2.586 1.00 0.00 H new ATOM 867 N MET A 768 4.560 -4.998 -0.616 1.00 0.00 N ATOM 868 CA MET A 768 3.327 -5.018 -1.386 1.00 0.00 C ATOM 869 C MET A 768 3.502 -4.198 -2.635 1.00 0.00 C ATOM 870 O MET A 768 4.283 -3.247 -2.672 1.00 0.00 O ATOM 871 CB MET A 768 2.169 -4.446 -0.573 1.00 0.00 C ATOM 872 CG MET A 768 0.795 -4.438 -1.262 1.00 0.00 C ATOM 873 SD MET A 768 0.425 -5.870 -2.278 1.00 0.00 S ATOM 874 CE MET A 768 0.457 -7.106 -1.019 1.00 0.00 C ATOM 0 H MET A 768 4.632 -4.218 0.037 1.00 0.00 H new ATOM 0 HA MET A 768 3.099 -6.052 -1.643 1.00 0.00 H new ATOM 0 HB2 MET A 768 2.085 -5.016 0.352 1.00 0.00 H new ATOM 0 HB3 MET A 768 2.419 -3.422 -0.295 1.00 0.00 H new ATOM 0 HG2 MET A 768 0.025 -4.351 -0.495 1.00 0.00 H new ATOM 0 HG3 MET A 768 0.727 -3.546 -1.885 1.00 0.00 H new ATOM 0 HE1 MET A 768 0.424 -8.094 -1.478 1.00 0.00 H new ATOM 0 HE2 MET A 768 1.372 -7.007 -0.435 1.00 0.00 H new ATOM 0 HE3 MET A 768 -0.406 -6.981 -0.365 1.00 0.00 H new ATOM 884 N ASP A 769 2.776 -4.576 -3.648 1.00 0.00 N ATOM 885 CA ASP A 769 2.821 -3.887 -4.901 1.00 0.00 C ATOM 886 C ASP A 769 1.429 -3.806 -5.475 1.00 0.00 C ATOM 887 O ASP A 769 0.497 -4.380 -4.928 1.00 0.00 O ATOM 888 CB ASP A 769 3.744 -4.609 -5.870 1.00 0.00 C ATOM 889 CG ASP A 769 5.207 -4.457 -5.500 1.00 0.00 C ATOM 890 OD1 ASP A 769 5.709 -5.285 -4.712 1.00 0.00 O ATOM 891 OD2 ASP A 769 5.849 -3.509 -5.999 1.00 0.00 O ATOM 0 H ASP A 769 2.137 -5.371 -3.626 1.00 0.00 H new ATOM 0 HA ASP A 769 3.209 -2.881 -4.743 1.00 0.00 H new ATOM 0 HB2 ASP A 769 3.486 -5.668 -5.892 1.00 0.00 H new ATOM 0 HB3 ASP A 769 3.585 -4.221 -6.876 1.00 0.00 H new ATOM 896 N LEU A 770 1.287 -3.060 -6.543 1.00 0.00 N ATOM 897 CA LEU A 770 0.005 -2.926 -7.196 1.00 0.00 C ATOM 898 C LEU A 770 -0.364 -4.184 -7.949 1.00 0.00 C ATOM 899 O LEU A 770 -1.543 -4.471 -8.122 1.00 0.00 O ATOM 900 CB LEU A 770 0.009 -1.729 -8.105 1.00 0.00 C ATOM 901 CG LEU A 770 0.696 -0.534 -7.514 1.00 0.00 C ATOM 902 CD1 LEU A 770 1.412 0.213 -8.586 1.00 0.00 C ATOM 903 CD2 LEU A 770 -0.316 0.348 -6.860 1.00 0.00 C ATOM 0 H LEU A 770 2.044 -2.535 -6.980 1.00 0.00 H new ATOM 0 HA LEU A 770 -0.755 -2.775 -6.430 1.00 0.00 H new ATOM 0 HB2 LEU A 770 0.500 -1.995 -9.041 1.00 0.00 H new ATOM 0 HB3 LEU A 770 -1.020 -1.464 -8.349 1.00 0.00 H new ATOM 0 HG LEU A 770 1.420 -0.860 -6.767 1.00 0.00 H new ATOM 0 HD11 LEU A 770 1.910 1.081 -8.154 1.00 0.00 H new ATOM 0 HD12 LEU A 770 2.153 -0.438 -9.050 1.00 0.00 H new ATOM 0 HD13 LEU A 770 0.697 0.543 -9.339 1.00 0.00 H new ATOM 0 HD21 LEU A 770 0.182 1.217 -6.430 1.00 0.00 H new ATOM 0 HD22 LEU A 770 -1.045 0.677 -7.601 1.00 0.00 H new ATOM 0 HD23 LEU A 770 -0.825 -0.205 -6.071 1.00 0.00 H new ATOM 915 N LYS A 771 0.629 -4.907 -8.450 1.00 0.00 N ATOM 916 CA LYS A 771 0.339 -6.163 -9.109 1.00 0.00 C ATOM 917 C LYS A 771 0.014 -7.184 -8.050 1.00 0.00 C ATOM 918 O LYS A 771 -0.858 -8.022 -8.231 1.00 0.00 O ATOM 919 CB LYS A 771 1.484 -6.673 -9.956 1.00 0.00 C ATOM 920 CG LYS A 771 0.993 -7.559 -11.076 1.00 0.00 C ATOM 921 CD LYS A 771 0.724 -6.743 -12.322 1.00 0.00 C ATOM 922 CE LYS A 771 -0.089 -7.528 -13.329 1.00 0.00 C ATOM 923 NZ LYS A 771 0.620 -8.757 -13.781 1.00 0.00 N ATOM 0 H LYS A 771 1.616 -4.651 -8.413 1.00 0.00 H new ATOM 0 HA LYS A 771 -0.499 -5.996 -9.785 1.00 0.00 H new ATOM 0 HB2 LYS A 771 2.034 -5.829 -10.373 1.00 0.00 H new ATOM 0 HB3 LYS A 771 2.181 -7.229 -9.330 1.00 0.00 H new ATOM 0 HG2 LYS A 771 1.736 -8.327 -11.291 1.00 0.00 H new ATOM 0 HG3 LYS A 771 0.083 -8.073 -10.768 1.00 0.00 H new ATOM 0 HD2 LYS A 771 0.192 -5.831 -12.054 1.00 0.00 H new ATOM 0 HD3 LYS A 771 1.669 -6.440 -12.772 1.00 0.00 H new ATOM 0 HE2 LYS A 771 -1.046 -7.804 -12.886 1.00 0.00 H new ATOM 0 HE3 LYS A 771 -0.306 -6.897 -14.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 0.068 -9.220 -14.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 1.558 -8.501 -14.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 0.729 -9.410 -12.979 1.00 0.00 H new ATOM 937 N THR A 772 0.765 -7.132 -6.954 1.00 0.00 N ATOM 938 CA THR A 772 0.501 -8.015 -5.832 1.00 0.00 C ATOM 939 C THR A 772 -0.886 -7.671 -5.304 1.00 0.00 C ATOM 940 O THR A 772 -1.687 -8.547 -4.982 1.00 0.00 O ATOM 941 CB THR A 772 1.536 -7.879 -4.706 1.00 0.00 C ATOM 942 OG1 THR A 772 2.852 -8.134 -5.214 1.00 0.00 O ATOM 943 CG2 THR A 772 1.218 -8.857 -3.586 1.00 0.00 C ATOM 0 H THR A 772 1.551 -6.495 -6.823 1.00 0.00 H new ATOM 0 HA THR A 772 0.562 -9.048 -6.176 1.00 0.00 H new ATOM 0 HB THR A 772 1.497 -6.863 -4.314 1.00 0.00 H new ATOM 0 HG1 THR A 772 3.506 -8.043 -4.489 1.00 0.00 H new ATOM 0 HG21 THR A 772 1.957 -8.753 -2.792 1.00 0.00 H new ATOM 0 HG22 THR A 772 0.226 -8.644 -3.188 1.00 0.00 H new ATOM 0 HG23 THR A 772 1.243 -9.875 -3.974 1.00 0.00 H new ATOM 951 N MET A 773 -1.143 -6.363 -5.204 1.00 0.00 N ATOM 952 CA MET A 773 -2.455 -5.856 -4.818 1.00 0.00 C ATOM 953 C MET A 773 -3.461 -6.488 -5.768 1.00 0.00 C ATOM 954 O MET A 773 -4.354 -7.215 -5.363 1.00 0.00 O ATOM 955 CB MET A 773 -2.488 -4.331 -4.958 1.00 0.00 C ATOM 956 CG MET A 773 -2.156 -3.588 -3.683 1.00 0.00 C ATOM 957 SD MET A 773 -3.333 -3.933 -2.385 1.00 0.00 S ATOM 958 CE MET A 773 -4.787 -3.163 -3.072 1.00 0.00 C ATOM 0 H MET A 773 -0.452 -5.635 -5.387 1.00 0.00 H new ATOM 0 HA MET A 773 -2.684 -6.102 -3.781 1.00 0.00 H new ATOM 0 HB2 MET A 773 -1.783 -4.033 -5.734 1.00 0.00 H new ATOM 0 HB3 MET A 773 -3.480 -4.029 -5.295 1.00 0.00 H new ATOM 0 HG2 MET A 773 -1.156 -3.867 -3.350 1.00 0.00 H new ATOM 0 HG3 MET A 773 -2.138 -2.516 -3.881 1.00 0.00 H new ATOM 0 HE1 MET A 773 -5.075 -2.313 -2.454 1.00 0.00 H new ATOM 0 HE2 MET A 773 -4.573 -2.820 -4.084 1.00 0.00 H new ATOM 0 HE3 MET A 773 -5.603 -3.885 -3.098 1.00 0.00 H new ATOM 968 N SER A 774 -3.253 -6.238 -7.056 1.00 0.00 N ATOM 969 CA SER A 774 -4.111 -6.775 -8.106 1.00 0.00 C ATOM 970 C SER A 774 -4.107 -8.294 -8.105 1.00 0.00 C ATOM 971 O SER A 774 -5.018 -8.917 -8.622 1.00 0.00 O ATOM 972 CB SER A 774 -3.672 -6.259 -9.459 1.00 0.00 C ATOM 973 OG SER A 774 -2.519 -6.936 -9.925 1.00 0.00 O ATOM 0 H SER A 774 -2.487 -5.659 -7.401 1.00 0.00 H new ATOM 0 HA SER A 774 -5.128 -6.439 -7.906 1.00 0.00 H new ATOM 0 HB2 SER A 774 -4.483 -6.383 -10.177 1.00 0.00 H new ATOM 0 HB3 SER A 774 -3.466 -5.191 -9.392 1.00 0.00 H new ATOM 0 HG SER A 774 -2.079 -7.387 -9.175 1.00 0.00 H new ATOM 979 N GLU A 775 -3.061 -8.883 -7.551 1.00 0.00 N ATOM 980 CA GLU A 775 -2.961 -10.330 -7.461 1.00 0.00 C ATOM 981 C GLU A 775 -4.059 -10.811 -6.543 1.00 0.00 C ATOM 982 O GLU A 775 -4.827 -11.726 -6.856 1.00 0.00 O ATOM 983 CB GLU A 775 -1.595 -10.711 -6.910 1.00 0.00 C ATOM 984 CG GLU A 775 -0.766 -11.552 -7.852 1.00 0.00 C ATOM 985 CD GLU A 775 0.278 -12.384 -7.134 1.00 0.00 C ATOM 986 OE1 GLU A 775 -0.064 -13.492 -6.668 1.00 0.00 O ATOM 987 OE2 GLU A 775 1.437 -11.930 -7.037 1.00 0.00 O ATOM 0 H GLU A 775 -2.267 -8.380 -7.156 1.00 0.00 H new ATOM 0 HA GLU A 775 -3.071 -10.791 -8.443 1.00 0.00 H new ATOM 0 HB2 GLU A 775 -1.044 -9.801 -6.671 1.00 0.00 H new ATOM 0 HB3 GLU A 775 -1.730 -11.256 -5.976 1.00 0.00 H new ATOM 0 HG2 GLU A 775 -1.424 -12.212 -8.417 1.00 0.00 H new ATOM 0 HG3 GLU A 775 -0.272 -10.901 -8.573 1.00 0.00 H new ATOM 994 N ARG A 776 -4.129 -10.141 -5.411 1.00 0.00 N ATOM 995 CA ARG A 776 -5.131 -10.408 -4.417 1.00 0.00 C ATOM 996 C ARG A 776 -6.487 -10.093 -5.013 1.00 0.00 C ATOM 997 O ARG A 776 -7.416 -10.891 -4.976 1.00 0.00 O ATOM 998 CB ARG A 776 -4.840 -9.540 -3.211 1.00 0.00 C ATOM 999 CG ARG A 776 -3.663 -10.049 -2.397 1.00 0.00 C ATOM 1000 CD ARG A 776 -2.722 -8.931 -1.977 1.00 0.00 C ATOM 1001 NE ARG A 776 -1.563 -9.444 -1.252 1.00 0.00 N ATOM 1002 CZ ARG A 776 -1.496 -9.521 0.075 1.00 0.00 C ATOM 1003 NH1 ARG A 776 -2.520 -9.127 0.819 1.00 0.00 N ATOM 1004 NH2 ARG A 776 -0.404 -9.995 0.658 1.00 0.00 N ATOM 0 H ARG A 776 -3.484 -9.392 -5.159 1.00 0.00 H new ATOM 0 HA ARG A 776 -5.125 -11.452 -4.105 1.00 0.00 H new ATOM 0 HB2 ARG A 776 -4.635 -8.522 -3.541 1.00 0.00 H new ATOM 0 HB3 ARG A 776 -5.725 -9.497 -2.576 1.00 0.00 H new ATOM 0 HG2 ARG A 776 -4.033 -10.561 -1.509 1.00 0.00 H new ATOM 0 HG3 ARG A 776 -3.111 -10.784 -2.982 1.00 0.00 H new ATOM 0 HD2 ARG A 776 -2.387 -8.386 -2.860 1.00 0.00 H new ATOM 0 HD3 ARG A 776 -3.259 -8.220 -1.349 1.00 0.00 H new ATOM 0 HE ARG A 776 -0.759 -9.761 -1.793 1.00 0.00 H new ATOM 0 HH11 ARG A 776 -3.363 -8.763 0.375 1.00 0.00 H new ATOM 0 HH12 ARG A 776 -2.465 -9.188 1.836 1.00 0.00 H new ATOM 0 HH21 ARG A 776 0.386 -10.301 0.090 1.00 0.00 H new ATOM 0 HH22 ARG A 776 -0.353 -10.054 1.675 1.00 0.00 H new ATOM 1018 N LEU A 777 -6.548 -8.918 -5.597 1.00 0.00 N ATOM 1019 CA LEU A 777 -7.736 -8.408 -6.258 1.00 0.00 C ATOM 1020 C LEU A 777 -8.285 -9.422 -7.219 1.00 0.00 C ATOM 1021 O LEU A 777 -9.451 -9.794 -7.151 1.00 0.00 O ATOM 1022 CB LEU A 777 -7.350 -7.140 -7.011 1.00 0.00 C ATOM 1023 CG LEU A 777 -8.476 -6.250 -7.522 1.00 0.00 C ATOM 1024 CD1 LEU A 777 -9.740 -7.004 -7.816 1.00 0.00 C ATOM 1025 CD2 LEU A 777 -8.745 -5.168 -6.510 1.00 0.00 C ATOM 0 H LEU A 777 -5.758 -8.273 -5.628 1.00 0.00 H new ATOM 0 HA LEU A 777 -8.506 -8.195 -5.517 1.00 0.00 H new ATOM 0 HB2 LEU A 777 -6.719 -6.540 -6.356 1.00 0.00 H new ATOM 0 HB3 LEU A 777 -6.738 -7.430 -7.865 1.00 0.00 H new ATOM 0 HG LEU A 777 -8.147 -5.821 -8.469 1.00 0.00 H new ATOM 0 HD11 LEU A 777 -10.501 -6.312 -8.176 1.00 0.00 H new ATOM 0 HD12 LEU A 777 -9.545 -7.758 -8.579 1.00 0.00 H new ATOM 0 HD13 LEU A 777 -10.093 -7.491 -6.907 1.00 0.00 H new ATOM 0 HD21 LEU A 777 -9.550 -4.526 -6.869 1.00 0.00 H new ATOM 0 HD22 LEU A 777 -9.036 -5.621 -5.562 1.00 0.00 H new ATOM 0 HD23 LEU A 777 -7.844 -4.573 -6.366 1.00 0.00 H new ATOM 1037 N LYS A 778 -7.434 -9.862 -8.112 1.00 0.00 N ATOM 1038 CA LYS A 778 -7.836 -10.806 -9.109 1.00 0.00 C ATOM 1039 C LYS A 778 -8.550 -11.982 -8.471 1.00 0.00 C ATOM 1040 O LYS A 778 -9.648 -12.357 -8.882 1.00 0.00 O ATOM 1041 CB LYS A 778 -6.645 -11.316 -9.888 1.00 0.00 C ATOM 1042 CG LYS A 778 -6.588 -10.765 -11.282 1.00 0.00 C ATOM 1043 CD LYS A 778 -5.821 -9.458 -11.341 1.00 0.00 C ATOM 1044 CE LYS A 778 -4.313 -9.688 -11.350 1.00 0.00 C ATOM 1045 NZ LYS A 778 -3.841 -10.209 -12.663 1.00 0.00 N ATOM 0 H LYS A 778 -6.456 -9.577 -8.164 1.00 0.00 H new ATOM 0 HA LYS A 778 -8.514 -10.293 -9.791 1.00 0.00 H new ATOM 0 HB2 LYS A 778 -5.729 -11.051 -9.359 1.00 0.00 H new ATOM 0 HB3 LYS A 778 -6.684 -12.404 -9.933 1.00 0.00 H new ATOM 0 HG2 LYS A 778 -6.116 -11.493 -11.942 1.00 0.00 H new ATOM 0 HG3 LYS A 778 -7.601 -10.609 -11.653 1.00 0.00 H new ATOM 0 HD2 LYS A 778 -6.110 -8.907 -12.236 1.00 0.00 H new ATOM 0 HD3 LYS A 778 -6.090 -8.840 -10.485 1.00 0.00 H new ATOM 0 HE2 LYS A 778 -3.801 -8.752 -11.125 1.00 0.00 H new ATOM 0 HE3 LYS A 778 -4.048 -10.394 -10.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 778 -2.803 -10.161 -12.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 778 -4.147 -11.197 -12.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 778 -4.244 -9.633 -13.430 1.00 0.00 H new ATOM 1059 N ASN A 779 -7.910 -12.560 -7.456 1.00 0.00 N ATOM 1060 CA ASN A 779 -8.487 -13.705 -6.764 1.00 0.00 C ATOM 1061 C ASN A 779 -9.633 -13.286 -5.851 1.00 0.00 C ATOM 1062 O ASN A 779 -10.214 -14.120 -5.155 1.00 0.00 O ATOM 1063 CB ASN A 779 -7.422 -14.468 -5.973 1.00 0.00 C ATOM 1064 CG ASN A 779 -7.281 -13.991 -4.542 1.00 0.00 C ATOM 1065 OD1 ASN A 779 -8.062 -14.367 -3.668 1.00 0.00 O ATOM 1066 ND2 ASN A 779 -6.267 -13.178 -4.292 1.00 0.00 N ATOM 0 H ASN A 779 -7.003 -12.257 -7.100 1.00 0.00 H new ATOM 0 HA ASN A 779 -8.891 -14.373 -7.525 1.00 0.00 H new ATOM 0 HB2 ASN A 779 -7.671 -15.529 -5.972 1.00 0.00 H new ATOM 0 HB3 ASN A 779 -6.462 -14.367 -6.479 1.00 0.00 H new ATOM 0 HD21 ASN A 779 -6.108 -12.837 -3.344 1.00 0.00 H new ATOM 0 HD22 ASN A 779 -5.644 -12.892 -5.048 1.00 0.00 H new ATOM 1073 N ARG A 780 -9.928 -11.988 -5.853 1.00 0.00 N ATOM 1074 CA ARG A 780 -11.032 -11.423 -5.078 1.00 0.00 C ATOM 1075 C ARG A 780 -10.680 -11.337 -3.599 1.00 0.00 C ATOM 1076 O ARG A 780 -11.559 -11.213 -2.745 1.00 0.00 O ATOM 1077 CB ARG A 780 -12.258 -12.295 -5.234 1.00 0.00 C ATOM 1078 CG ARG A 780 -12.548 -12.695 -6.669 1.00 0.00 C ATOM 1079 CD ARG A 780 -13.606 -11.825 -7.287 1.00 0.00 C ATOM 1080 NE ARG A 780 -14.737 -12.600 -7.796 1.00 0.00 N ATOM 1081 CZ ARG A 780 -15.997 -12.174 -7.775 1.00 0.00 C ATOM 1082 NH1 ARG A 780 -16.295 -10.995 -7.247 1.00 0.00 N ATOM 1083 NH2 ARG A 780 -16.961 -12.933 -8.278 1.00 0.00 N ATOM 0 H ARG A 780 -9.408 -11.296 -6.393 1.00 0.00 H new ATOM 0 HA ARG A 780 -11.227 -10.418 -5.453 1.00 0.00 H new ATOM 0 HB2 ARG A 780 -12.130 -13.196 -4.635 1.00 0.00 H new ATOM 0 HB3 ARG A 780 -13.122 -11.766 -4.833 1.00 0.00 H new ATOM 0 HG2 ARG A 780 -11.633 -12.628 -7.257 1.00 0.00 H new ATOM 0 HG3 ARG A 780 -12.870 -13.736 -6.698 1.00 0.00 H new ATOM 0 HD2 ARG A 780 -13.963 -11.110 -6.546 1.00 0.00 H new ATOM 0 HD3 ARG A 780 -13.168 -11.248 -8.102 1.00 0.00 H new ATOM 0 HE ARG A 780 -14.549 -13.522 -8.190 1.00 0.00 H new ATOM 0 HH11 ARG A 780 -15.557 -10.411 -6.855 1.00 0.00 H new ATOM 0 HH12 ARG A 780 -17.263 -10.672 -7.233 1.00 0.00 H new ATOM 0 HH21 ARG A 780 -16.736 -13.843 -8.681 1.00 0.00 H new ATOM 0 HH22 ARG A 780 -17.927 -12.607 -8.262 1.00 0.00 H new ATOM 1097 N TYR A 781 -9.394 -11.411 -3.314 1.00 0.00 N ATOM 1098 CA TYR A 781 -8.893 -11.373 -1.952 1.00 0.00 C ATOM 1099 C TYR A 781 -9.484 -10.221 -1.153 1.00 0.00 C ATOM 1100 O TYR A 781 -9.822 -10.388 0.017 1.00 0.00 O ATOM 1101 CB TYR A 781 -7.375 -11.253 -2.002 1.00 0.00 C ATOM 1102 CG TYR A 781 -6.693 -10.916 -0.701 1.00 0.00 C ATOM 1103 CD1 TYR A 781 -6.581 -9.603 -0.291 1.00 0.00 C ATOM 1104 CD2 TYR A 781 -6.116 -11.904 0.085 1.00 0.00 C ATOM 1105 CE1 TYR A 781 -5.918 -9.268 0.860 1.00 0.00 C ATOM 1106 CE2 TYR A 781 -5.453 -11.583 1.254 1.00 0.00 C ATOM 1107 CZ TYR A 781 -5.354 -10.263 1.637 1.00 0.00 C ATOM 1108 OH TYR A 781 -4.679 -9.937 2.791 1.00 0.00 O ATOM 0 H TYR A 781 -8.665 -11.499 -4.022 1.00 0.00 H new ATOM 0 HA TYR A 781 -9.191 -12.291 -1.446 1.00 0.00 H new ATOM 0 HB2 TYR A 781 -6.968 -12.196 -2.368 1.00 0.00 H new ATOM 0 HB3 TYR A 781 -7.115 -10.488 -2.734 1.00 0.00 H new ATOM 0 HD1 TYR A 781 -7.026 -8.823 -0.891 1.00 0.00 H new ATOM 0 HD2 TYR A 781 -6.186 -12.937 -0.221 1.00 0.00 H new ATOM 0 HE1 TYR A 781 -5.836 -8.233 1.159 1.00 0.00 H new ATOM 0 HE2 TYR A 781 -5.016 -12.361 1.863 1.00 0.00 H new ATOM 0 HH TYR A 781 -4.346 -10.754 3.217 1.00 0.00 H new ATOM 1118 N TYR A 782 -9.617 -9.060 -1.787 1.00 0.00 N ATOM 1119 CA TYR A 782 -10.129 -7.884 -1.105 1.00 0.00 C ATOM 1120 C TYR A 782 -11.587 -7.996 -0.762 1.00 0.00 C ATOM 1121 O TYR A 782 -12.459 -7.463 -1.449 1.00 0.00 O ATOM 1122 CB TYR A 782 -9.849 -6.629 -1.916 1.00 0.00 C ATOM 1123 CG TYR A 782 -8.419 -6.534 -2.252 1.00 0.00 C ATOM 1124 CD1 TYR A 782 -7.531 -6.139 -1.304 1.00 0.00 C ATOM 1125 CD2 TYR A 782 -7.949 -6.890 -3.485 1.00 0.00 C ATOM 1126 CE1 TYR A 782 -6.203 -6.097 -1.561 1.00 0.00 C ATOM 1127 CE2 TYR A 782 -6.608 -6.831 -3.758 1.00 0.00 C ATOM 1128 CZ TYR A 782 -5.742 -6.437 -2.783 1.00 0.00 C ATOM 1129 OH TYR A 782 -4.403 -6.410 -3.022 1.00 0.00 O ATOM 0 H TYR A 782 -9.378 -8.912 -2.767 1.00 0.00 H new ATOM 0 HA TYR A 782 -9.597 -7.812 -0.156 1.00 0.00 H new ATOM 0 HB2 TYR A 782 -10.442 -6.641 -2.830 1.00 0.00 H new ATOM 0 HB3 TYR A 782 -10.154 -5.749 -1.350 1.00 0.00 H new ATOM 0 HD1 TYR A 782 -7.891 -5.853 -0.327 1.00 0.00 H new ATOM 0 HD2 TYR A 782 -8.639 -7.220 -4.248 1.00 0.00 H new ATOM 0 HE1 TYR A 782 -5.513 -5.792 -0.789 1.00 0.00 H new ATOM 0 HE2 TYR A 782 -6.240 -7.095 -4.739 1.00 0.00 H new ATOM 0 HH TYR A 782 -4.004 -5.641 -2.564 1.00 0.00 H new ATOM 1139 N VAL A 783 -11.833 -8.706 0.319 1.00 0.00 N ATOM 1140 CA VAL A 783 -13.163 -8.862 0.832 1.00 0.00 C ATOM 1141 C VAL A 783 -13.396 -7.750 1.819 1.00 0.00 C ATOM 1142 O VAL A 783 -14.325 -7.770 2.626 1.00 0.00 O ATOM 1143 CB VAL A 783 -13.346 -10.219 1.506 1.00 0.00 C ATOM 1144 CG1 VAL A 783 -13.364 -11.303 0.460 1.00 0.00 C ATOM 1145 CG2 VAL A 783 -12.244 -10.443 2.505 1.00 0.00 C ATOM 0 H VAL A 783 -11.114 -9.187 0.860 1.00 0.00 H new ATOM 0 HA VAL A 783 -13.884 -8.816 0.015 1.00 0.00 H new ATOM 0 HB VAL A 783 -14.296 -10.242 2.039 1.00 0.00 H new ATOM 0 HG11 VAL A 783 -13.495 -12.272 0.942 1.00 0.00 H new ATOM 0 HG12 VAL A 783 -14.188 -11.128 -0.232 1.00 0.00 H new ATOM 0 HG13 VAL A 783 -12.422 -11.295 -0.089 1.00 0.00 H new ATOM 0 HG21 VAL A 783 -12.379 -11.413 2.984 1.00 0.00 H new ATOM 0 HG22 VAL A 783 -11.281 -10.420 1.995 1.00 0.00 H new ATOM 0 HG23 VAL A 783 -12.273 -9.658 3.261 1.00 0.00 H new ATOM 1155 N SER A 784 -12.509 -6.775 1.717 1.00 0.00 N ATOM 1156 CA SER A 784 -12.512 -5.623 2.579 1.00 0.00 C ATOM 1157 C SER A 784 -11.619 -4.537 1.988 1.00 0.00 C ATOM 1158 O SER A 784 -10.447 -4.789 1.712 1.00 0.00 O ATOM 1159 CB SER A 784 -11.990 -6.043 3.938 1.00 0.00 C ATOM 1160 OG SER A 784 -12.980 -5.900 4.942 1.00 0.00 O ATOM 0 H SER A 784 -11.761 -6.768 1.023 1.00 0.00 H new ATOM 0 HA SER A 784 -13.523 -5.226 2.676 1.00 0.00 H new ATOM 0 HB2 SER A 784 -11.659 -7.081 3.897 1.00 0.00 H new ATOM 0 HB3 SER A 784 -11.119 -5.441 4.196 1.00 0.00 H new ATOM 0 HG SER A 784 -12.613 -6.181 5.806 1.00 0.00 H new ATOM 1166 N LYS A 785 -12.162 -3.334 1.768 1.00 0.00 N ATOM 1167 CA LYS A 785 -11.352 -2.250 1.214 1.00 0.00 C ATOM 1168 C LYS A 785 -10.140 -2.025 2.084 1.00 0.00 C ATOM 1169 O LYS A 785 -9.212 -1.349 1.675 1.00 0.00 O ATOM 1170 CB LYS A 785 -12.124 -0.935 1.102 1.00 0.00 C ATOM 1171 CG LYS A 785 -12.587 -0.371 2.436 1.00 0.00 C ATOM 1172 CD LYS A 785 -14.065 -0.015 2.416 1.00 0.00 C ATOM 1173 CE LYS A 785 -14.933 -1.260 2.424 1.00 0.00 C ATOM 1174 NZ LYS A 785 -16.383 -0.922 2.436 1.00 0.00 N ATOM 0 H LYS A 785 -13.134 -3.092 1.960 1.00 0.00 H new ATOM 0 HA LYS A 785 -11.061 -2.555 0.209 1.00 0.00 H new ATOM 0 HB2 LYS A 785 -11.493 -0.197 0.607 1.00 0.00 H new ATOM 0 HB3 LYS A 785 -12.994 -1.090 0.464 1.00 0.00 H new ATOM 0 HG2 LYS A 785 -12.399 -1.101 3.224 1.00 0.00 H new ATOM 0 HG3 LYS A 785 -12.003 0.517 2.678 1.00 0.00 H new ATOM 0 HD2 LYS A 785 -14.304 0.603 3.282 1.00 0.00 H new ATOM 0 HD3 LYS A 785 -14.286 0.579 1.529 1.00 0.00 H new ATOM 0 HE2 LYS A 785 -14.708 -1.866 1.546 1.00 0.00 H new ATOM 0 HE3 LYS A 785 -14.693 -1.865 3.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 785 -16.914 -1.686 2.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 785 -16.528 -0.033 2.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 785 -16.722 -0.811 1.459 1.00 0.00 H new ATOM 1188 N LYS A 786 -10.166 -2.577 3.297 1.00 0.00 N ATOM 1189 CA LYS A 786 -9.047 -2.426 4.209 1.00 0.00 C ATOM 1190 C LYS A 786 -7.910 -3.347 3.805 1.00 0.00 C ATOM 1191 O LYS A 786 -6.749 -3.040 4.032 1.00 0.00 O ATOM 1192 CB LYS A 786 -9.463 -2.673 5.662 1.00 0.00 C ATOM 1193 CG LYS A 786 -10.303 -1.552 6.262 1.00 0.00 C ATOM 1194 CD LYS A 786 -11.739 -1.594 5.765 1.00 0.00 C ATOM 1195 CE LYS A 786 -12.489 -2.796 6.318 1.00 0.00 C ATOM 1196 NZ LYS A 786 -13.880 -2.875 5.791 1.00 0.00 N ATOM 0 H LYS A 786 -10.944 -3.126 3.663 1.00 0.00 H new ATOM 0 HA LYS A 786 -8.700 -1.395 4.145 1.00 0.00 H new ATOM 0 HB2 LYS A 786 -10.027 -3.605 5.715 1.00 0.00 H new ATOM 0 HB3 LYS A 786 -8.567 -2.807 6.268 1.00 0.00 H new ATOM 0 HG2 LYS A 786 -10.292 -1.632 7.349 1.00 0.00 H new ATOM 0 HG3 LYS A 786 -9.859 -0.589 6.009 1.00 0.00 H new ATOM 0 HD2 LYS A 786 -12.253 -0.678 6.058 1.00 0.00 H new ATOM 0 HD3 LYS A 786 -11.746 -1.630 4.676 1.00 0.00 H new ATOM 0 HE2 LYS A 786 -11.951 -3.709 6.061 1.00 0.00 H new ATOM 0 HE3 LYS A 786 -12.516 -2.738 7.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 786 -14.428 -3.552 6.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 786 -14.326 -1.937 5.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 786 -13.859 -3.191 4.800 1.00 0.00 H new ATOM 1210 N LEU A 787 -8.245 -4.501 3.252 1.00 0.00 N ATOM 1211 CA LEU A 787 -7.231 -5.403 2.744 1.00 0.00 C ATOM 1212 C LEU A 787 -6.503 -4.655 1.689 1.00 0.00 C ATOM 1213 O LEU A 787 -5.278 -4.577 1.622 1.00 0.00 O ATOM 1214 CB LEU A 787 -7.894 -6.588 2.076 1.00 0.00 C ATOM 1215 CG LEU A 787 -8.295 -7.683 3.005 1.00 0.00 C ATOM 1216 CD1 LEU A 787 -9.024 -8.761 2.239 1.00 0.00 C ATOM 1217 CD2 LEU A 787 -7.063 -8.191 3.715 1.00 0.00 C ATOM 0 H LEU A 787 -9.204 -4.831 3.145 1.00 0.00 H new ATOM 0 HA LEU A 787 -6.581 -5.748 3.549 1.00 0.00 H new ATOM 0 HB2 LEU A 787 -8.779 -6.239 1.544 1.00 0.00 H new ATOM 0 HB3 LEU A 787 -7.212 -6.995 1.329 1.00 0.00 H new ATOM 0 HG LEU A 787 -8.988 -7.320 3.764 1.00 0.00 H new ATOM 0 HD11 LEU A 787 -9.315 -9.559 2.922 1.00 0.00 H new ATOM 0 HD12 LEU A 787 -9.915 -8.338 1.774 1.00 0.00 H new ATOM 0 HD13 LEU A 787 -8.369 -9.165 1.467 1.00 0.00 H new ATOM 0 HD21 LEU A 787 -7.342 -8.993 4.398 1.00 0.00 H new ATOM 0 HD22 LEU A 787 -6.351 -8.570 2.982 1.00 0.00 H new ATOM 0 HD23 LEU A 787 -6.606 -7.377 4.278 1.00 0.00 H new ATOM 1229 N PHE A 788 -7.351 -4.113 0.873 1.00 0.00 N ATOM 1230 CA PHE A 788 -7.003 -3.318 -0.242 1.00 0.00 C ATOM 1231 C PHE A 788 -6.280 -2.073 0.176 1.00 0.00 C ATOM 1232 O PHE A 788 -5.304 -1.659 -0.447 1.00 0.00 O ATOM 1233 CB PHE A 788 -8.274 -2.995 -0.932 1.00 0.00 C ATOM 1234 CG PHE A 788 -7.963 -2.569 -2.273 1.00 0.00 C ATOM 1235 CD1 PHE A 788 -7.651 -1.291 -2.424 1.00 0.00 C ATOM 1236 CD2 PHE A 788 -7.938 -3.414 -3.349 1.00 0.00 C ATOM 1237 CE1 PHE A 788 -7.312 -0.788 -3.617 1.00 0.00 C ATOM 1238 CE2 PHE A 788 -7.595 -2.922 -4.580 1.00 0.00 C ATOM 1239 CZ PHE A 788 -7.284 -1.600 -4.711 1.00 0.00 C ATOM 0 H PHE A 788 -8.359 -4.225 0.981 1.00 0.00 H new ATOM 0 HA PHE A 788 -6.320 -3.851 -0.903 1.00 0.00 H new ATOM 0 HB2 PHE A 788 -8.928 -3.867 -0.952 1.00 0.00 H new ATOM 0 HB3 PHE A 788 -8.808 -2.209 -0.398 1.00 0.00 H new ATOM 0 HD1 PHE A 788 -7.671 -0.639 -1.563 1.00 0.00 H new ATOM 0 HD2 PHE A 788 -8.186 -4.458 -3.229 1.00 0.00 H new ATOM 0 HE1 PHE A 788 -7.061 0.258 -3.712 1.00 0.00 H new ATOM 0 HE2 PHE A 788 -7.571 -3.575 -5.440 1.00 0.00 H new ATOM 0 HZ PHE A 788 -7.017 -1.199 -5.677 1.00 0.00 H new ATOM 1249 N MET A 789 -6.763 -1.482 1.232 1.00 0.00 N ATOM 1250 CA MET A 789 -6.168 -0.291 1.744 1.00 0.00 C ATOM 1251 C MET A 789 -4.798 -0.621 2.272 1.00 0.00 C ATOM 1252 O MET A 789 -3.803 -0.202 1.725 1.00 0.00 O ATOM 1253 CB MET A 789 -7.027 0.268 2.838 1.00 0.00 C ATOM 1254 CG MET A 789 -8.118 1.162 2.306 1.00 0.00 C ATOM 1255 SD MET A 789 -8.217 2.685 3.230 1.00 0.00 S ATOM 1256 CE MET A 789 -7.534 3.783 2.008 1.00 0.00 C ATOM 0 H MET A 789 -7.574 -1.813 1.755 1.00 0.00 H new ATOM 0 HA MET A 789 -6.081 0.455 0.954 1.00 0.00 H new ATOM 0 HB2 MET A 789 -7.474 -0.551 3.401 1.00 0.00 H new ATOM 0 HB3 MET A 789 -6.405 0.831 3.534 1.00 0.00 H new ATOM 0 HG2 MET A 789 -7.930 1.383 1.255 1.00 0.00 H new ATOM 0 HG3 MET A 789 -9.074 0.641 2.356 1.00 0.00 H new ATOM 0 HE1 MET A 789 -6.812 4.449 2.480 1.00 0.00 H new ATOM 0 HE2 MET A 789 -7.037 3.200 1.232 1.00 0.00 H new ATOM 0 HE3 MET A 789 -8.334 4.374 1.562 1.00 0.00 H new ATOM 1266 N ALA A 790 -4.788 -1.442 3.301 1.00 0.00 N ATOM 1267 CA ALA A 790 -3.567 -1.884 3.958 1.00 0.00 C ATOM 1268 C ALA A 790 -2.481 -2.298 2.983 1.00 0.00 C ATOM 1269 O ALA A 790 -1.338 -1.888 3.127 1.00 0.00 O ATOM 1270 CB ALA A 790 -3.880 -3.073 4.836 1.00 0.00 C ATOM 0 H ALA A 790 -5.637 -1.829 3.713 1.00 0.00 H new ATOM 0 HA ALA A 790 -3.196 -1.036 4.534 1.00 0.00 H new ATOM 0 HB1 ALA A 790 -2.969 -3.409 5.331 1.00 0.00 H new ATOM 0 HB2 ALA A 790 -4.617 -2.787 5.587 1.00 0.00 H new ATOM 0 HB3 ALA A 790 -4.280 -3.882 4.224 1.00 0.00 H new ATOM 1276 N ASP A 791 -2.842 -3.130 2.013 1.00 0.00 N ATOM 1277 CA ASP A 791 -1.876 -3.635 1.045 1.00 0.00 C ATOM 1278 C ASP A 791 -1.426 -2.543 0.075 1.00 0.00 C ATOM 1279 O ASP A 791 -0.238 -2.286 -0.057 1.00 0.00 O ATOM 1280 CB ASP A 791 -2.444 -4.845 0.309 1.00 0.00 C ATOM 1281 CG ASP A 791 -2.510 -6.078 1.190 1.00 0.00 C ATOM 1282 OD1 ASP A 791 -1.444 -6.541 1.643 1.00 0.00 O ATOM 1283 OD2 ASP A 791 -3.629 -6.580 1.427 1.00 0.00 O ATOM 0 H ASP A 791 -3.794 -3.469 1.876 1.00 0.00 H new ATOM 0 HA ASP A 791 -0.988 -3.956 1.589 1.00 0.00 H new ATOM 0 HB2 ASP A 791 -3.443 -4.609 -0.056 1.00 0.00 H new ATOM 0 HB3 ASP A 791 -1.828 -5.058 -0.564 1.00 0.00 H new ATOM 1288 N LEU A 792 -2.339 -1.899 -0.628 1.00 0.00 N ATOM 1289 CA LEU A 792 -1.919 -0.821 -1.515 1.00 0.00 C ATOM 1290 C LEU A 792 -1.132 0.164 -0.688 1.00 0.00 C ATOM 1291 O LEU A 792 -0.147 0.751 -1.136 1.00 0.00 O ATOM 1292 CB LEU A 792 -3.118 -0.101 -2.131 1.00 0.00 C ATOM 1293 CG LEU A 792 -3.204 -0.120 -3.632 1.00 0.00 C ATOM 1294 CD1 LEU A 792 -4.294 0.823 -4.078 1.00 0.00 C ATOM 1295 CD2 LEU A 792 -1.871 0.247 -4.234 1.00 0.00 C ATOM 0 H LEU A 792 -3.341 -2.090 -0.609 1.00 0.00 H new ATOM 0 HA LEU A 792 -1.325 -1.237 -2.329 1.00 0.00 H new ATOM 0 HB2 LEU A 792 -4.028 -0.547 -1.730 1.00 0.00 H new ATOM 0 HB3 LEU A 792 -3.100 0.938 -1.802 1.00 0.00 H new ATOM 0 HG LEU A 792 -3.453 -1.123 -3.978 1.00 0.00 H new ATOM 0 HD11 LEU A 792 -4.361 0.813 -5.166 1.00 0.00 H new ATOM 0 HD12 LEU A 792 -5.246 0.505 -3.653 1.00 0.00 H new ATOM 0 HD13 LEU A 792 -4.063 1.833 -3.738 1.00 0.00 H new ATOM 0 HD21 LEU A 792 -1.946 0.230 -5.321 1.00 0.00 H new ATOM 0 HD22 LEU A 792 -1.586 1.247 -3.906 1.00 0.00 H new ATOM 0 HD23 LEU A 792 -1.116 -0.470 -3.911 1.00 0.00 H new ATOM 1307 N GLN A 793 -1.581 0.307 0.544 1.00 0.00 N ATOM 1308 CA GLN A 793 -0.948 1.188 1.491 1.00 0.00 C ATOM 1309 C GLN A 793 0.358 0.566 1.905 1.00 0.00 C ATOM 1310 O GLN A 793 1.304 1.240 2.302 1.00 0.00 O ATOM 1311 CB GLN A 793 -1.842 1.396 2.703 1.00 0.00 C ATOM 1312 CG GLN A 793 -2.989 2.341 2.440 1.00 0.00 C ATOM 1313 CD GLN A 793 -3.926 2.455 3.627 1.00 0.00 C ATOM 1314 OE1 GLN A 793 -3.501 2.332 4.776 1.00 0.00 O ATOM 1315 NE2 GLN A 793 -5.208 2.684 3.362 1.00 0.00 N ATOM 0 H GLN A 793 -2.395 -0.186 0.911 1.00 0.00 H new ATOM 0 HA GLN A 793 -0.773 2.163 1.036 1.00 0.00 H new ATOM 0 HB2 GLN A 793 -2.239 0.433 3.023 1.00 0.00 H new ATOM 0 HB3 GLN A 793 -1.242 1.783 3.527 1.00 0.00 H new ATOM 0 HG2 GLN A 793 -2.595 3.327 2.195 1.00 0.00 H new ATOM 0 HG3 GLN A 793 -3.548 1.996 1.570 1.00 0.00 H new ATOM 0 HE21 GLN A 793 -5.520 2.780 2.396 1.00 0.00 H new ATOM 0 HE22 GLN A 793 -5.880 2.764 4.125 1.00 0.00 H new ATOM 1324 N ARG A 794 0.374 -0.753 1.803 1.00 0.00 N ATOM 1325 CA ARG A 794 1.532 -1.546 2.117 1.00 0.00 C ATOM 1326 C ARG A 794 2.605 -1.268 1.078 1.00 0.00 C ATOM 1327 O ARG A 794 3.792 -1.433 1.346 1.00 0.00 O ATOM 1328 CB ARG A 794 1.162 -3.022 2.154 1.00 0.00 C ATOM 1329 CG ARG A 794 2.306 -3.883 2.618 1.00 0.00 C ATOM 1330 CD ARG A 794 2.695 -3.610 4.049 1.00 0.00 C ATOM 1331 NE ARG A 794 4.030 -3.021 4.146 1.00 0.00 N ATOM 1332 CZ ARG A 794 4.462 -2.323 5.194 1.00 0.00 C ATOM 1333 NH1 ARG A 794 3.661 -2.107 6.230 1.00 0.00 N ATOM 1334 NH2 ARG A 794 5.693 -1.834 5.202 1.00 0.00 N ATOM 0 H ARG A 794 -0.430 -1.301 1.496 1.00 0.00 H new ATOM 0 HA ARG A 794 1.916 -1.282 3.102 1.00 0.00 H new ATOM 0 HB2 ARG A 794 0.309 -3.165 2.818 1.00 0.00 H new ATOM 0 HB3 ARG A 794 0.849 -3.341 1.160 1.00 0.00 H new ATOM 0 HG2 ARG A 794 2.031 -4.933 2.514 1.00 0.00 H new ATOM 0 HG3 ARG A 794 3.168 -3.714 1.973 1.00 0.00 H new ATOM 0 HD2 ARG A 794 1.967 -2.937 4.501 1.00 0.00 H new ATOM 0 HD3 ARG A 794 2.666 -4.540 4.617 1.00 0.00 H new ATOM 0 HE ARG A 794 4.670 -3.153 3.362 1.00 0.00 H new ATOM 0 HH11 ARG A 794 2.710 -2.476 6.225 1.00 0.00 H new ATOM 0 HH12 ARG A 794 3.996 -1.572 7.031 1.00 0.00 H new ATOM 0 HH21 ARG A 794 6.310 -1.992 4.405 1.00 0.00 H new ATOM 0 HH22 ARG A 794 6.024 -1.299 6.005 1.00 0.00 H new ATOM 1348 N VAL A 795 2.183 -0.836 -0.120 1.00 0.00 N ATOM 1349 CA VAL A 795 3.144 -0.498 -1.157 1.00 0.00 C ATOM 1350 C VAL A 795 3.683 0.900 -0.873 1.00 0.00 C ATOM 1351 O VAL A 795 4.856 1.052 -0.564 1.00 0.00 O ATOM 1352 CB VAL A 795 2.585 -0.623 -2.617 1.00 0.00 C ATOM 1353 CG1 VAL A 795 1.369 -1.515 -2.639 1.00 0.00 C ATOM 1354 CG2 VAL A 795 2.267 0.715 -3.284 1.00 0.00 C ATOM 0 H VAL A 795 1.204 -0.717 -0.382 1.00 0.00 H new ATOM 0 HA VAL A 795 3.950 -1.231 -1.119 1.00 0.00 H new ATOM 0 HB VAL A 795 3.389 -1.067 -3.204 1.00 0.00 H new ATOM 0 HG11 VAL A 795 0.993 -1.592 -3.659 1.00 0.00 H new ATOM 0 HG12 VAL A 795 1.639 -2.507 -2.276 1.00 0.00 H new ATOM 0 HG13 VAL A 795 0.596 -1.092 -1.998 1.00 0.00 H new ATOM 0 HG21 VAL A 795 1.886 0.539 -4.290 1.00 0.00 H new ATOM 0 HG22 VAL A 795 1.515 1.244 -2.699 1.00 0.00 H new ATOM 0 HG23 VAL A 795 3.173 1.318 -3.340 1.00 0.00 H new ATOM 1364 N PHE A 796 2.801 1.901 -0.879 1.00 0.00 N ATOM 1365 CA PHE A 796 3.209 3.285 -0.617 1.00 0.00 C ATOM 1366 C PHE A 796 4.088 3.343 0.621 1.00 0.00 C ATOM 1367 O PHE A 796 5.129 3.997 0.627 1.00 0.00 O ATOM 1368 CB PHE A 796 2.005 4.193 -0.392 1.00 0.00 C ATOM 1369 CG PHE A 796 0.777 3.799 -1.151 1.00 0.00 C ATOM 1370 CD1 PHE A 796 0.829 3.489 -2.494 1.00 0.00 C ATOM 1371 CD2 PHE A 796 -0.433 3.720 -0.512 1.00 0.00 C ATOM 1372 CE1 PHE A 796 -0.297 3.108 -3.177 1.00 0.00 C ATOM 1373 CE2 PHE A 796 -1.559 3.339 -1.196 1.00 0.00 C ATOM 1374 CZ PHE A 796 -1.481 3.033 -2.535 1.00 0.00 C ATOM 0 H PHE A 796 1.804 1.782 -1.061 1.00 0.00 H new ATOM 0 HA PHE A 796 3.756 3.632 -1.494 1.00 0.00 H new ATOM 0 HB2 PHE A 796 1.770 4.206 0.672 1.00 0.00 H new ATOM 0 HB3 PHE A 796 2.277 5.211 -0.670 1.00 0.00 H new ATOM 0 HD1 PHE A 796 1.773 3.547 -3.016 1.00 0.00 H new ATOM 0 HD2 PHE A 796 -0.500 3.960 0.539 1.00 0.00 H new ATOM 0 HE1 PHE A 796 -0.236 2.868 -4.228 1.00 0.00 H new ATOM 0 HE2 PHE A 796 -2.508 3.279 -0.683 1.00 0.00 H new ATOM 0 HZ PHE A 796 -2.368 2.733 -3.072 1.00 0.00 H new ATOM 1384 N THR A 797 3.655 2.645 1.669 1.00 0.00 N ATOM 1385 CA THR A 797 4.387 2.616 2.925 1.00 0.00 C ATOM 1386 C THR A 797 5.743 1.941 2.752 1.00 0.00 C ATOM 1387 O THR A 797 6.740 2.424 3.276 1.00 0.00 O ATOM 1388 CB THR A 797 3.592 1.910 4.042 1.00 0.00 C ATOM 1389 OG1 THR A 797 4.089 2.310 5.324 1.00 0.00 O ATOM 1390 CG2 THR A 797 3.683 0.399 3.917 1.00 0.00 C ATOM 0 H THR A 797 2.798 2.092 1.669 1.00 0.00 H new ATOM 0 HA THR A 797 4.540 3.653 3.223 1.00 0.00 H new ATOM 0 HB THR A 797 2.547 2.202 3.942 1.00 0.00 H new ATOM 0 HG1 THR A 797 4.987 1.941 5.456 1.00 0.00 H new ATOM 0 HG21 THR A 797 3.112 -0.068 4.720 1.00 0.00 H new ATOM 0 HG22 THR A 797 3.277 0.088 2.954 1.00 0.00 H new ATOM 0 HG23 THR A 797 4.726 0.090 3.987 1.00 0.00 H new ATOM 1398 N ASN A 798 5.780 0.813 2.036 1.00 0.00 N ATOM 1399 CA ASN A 798 7.041 0.124 1.795 1.00 0.00 C ATOM 1400 C ASN A 798 7.914 1.000 0.922 1.00 0.00 C ATOM 1401 O ASN A 798 9.139 0.887 0.921 1.00 0.00 O ATOM 1402 CB ASN A 798 6.824 -1.237 1.128 1.00 0.00 C ATOM 1403 CG ASN A 798 6.953 -1.191 -0.388 1.00 0.00 C ATOM 1404 OD1 ASN A 798 5.961 -1.149 -1.107 1.00 0.00 O ATOM 1405 ND2 ASN A 798 8.185 -1.198 -0.884 1.00 0.00 N ATOM 0 H ASN A 798 4.962 0.367 1.621 1.00 0.00 H new ATOM 0 HA ASN A 798 7.528 -0.060 2.753 1.00 0.00 H new ATOM 0 HB2 ASN A 798 7.547 -1.949 1.526 1.00 0.00 H new ATOM 0 HB3 ASN A 798 5.834 -1.609 1.390 1.00 0.00 H new ATOM 0 HD21 ASN A 798 8.329 -1.168 -1.893 1.00 0.00 H new ATOM 0 HD22 ASN A 798 8.988 -1.233 -0.256 1.00 0.00 H new ATOM 1412 N CYS A 799 7.262 1.889 0.184 1.00 0.00 N ATOM 1413 CA CYS A 799 7.952 2.794 -0.688 1.00 0.00 C ATOM 1414 C CYS A 799 8.436 3.983 0.119 1.00 0.00 C ATOM 1415 O CYS A 799 9.422 4.634 -0.207 1.00 0.00 O ATOM 1416 CB CYS A 799 7.033 3.161 -1.831 1.00 0.00 C ATOM 1417 SG CYS A 799 6.258 1.708 -2.562 1.00 0.00 S ATOM 0 H CYS A 799 6.247 1.993 0.182 1.00 0.00 H new ATOM 0 HA CYS A 799 8.838 2.339 -1.130 1.00 0.00 H new ATOM 0 HB2 CYS A 799 6.262 3.842 -1.472 1.00 0.00 H new ATOM 0 HB3 CYS A 799 7.599 3.694 -2.595 1.00 0.00 H new ATOM 0 HG CYS A 799 6.252 1.825 -3.857 1.00 0.00 H new ATOM 1423 N LYS A 800 7.696 4.247 1.173 1.00 0.00 N ATOM 1424 CA LYS A 800 7.995 5.290 2.132 1.00 0.00 C ATOM 1425 C LYS A 800 8.966 4.754 3.194 1.00 0.00 C ATOM 1426 O LYS A 800 9.625 5.505 3.910 1.00 0.00 O ATOM 1427 CB LYS A 800 6.694 5.687 2.782 1.00 0.00 C ATOM 1428 CG LYS A 800 5.849 6.639 1.982 1.00 0.00 C ATOM 1429 CD LYS A 800 4.381 6.423 2.290 1.00 0.00 C ATOM 1430 CE LYS A 800 3.521 7.370 1.505 1.00 0.00 C ATOM 1431 NZ LYS A 800 2.094 7.322 1.928 1.00 0.00 N ATOM 0 H LYS A 800 6.846 3.728 1.394 1.00 0.00 H new ATOM 0 HA LYS A 800 8.459 6.146 1.643 1.00 0.00 H new ATOM 0 HB2 LYS A 800 6.113 4.786 2.978 1.00 0.00 H new ATOM 0 HB3 LYS A 800 6.912 6.142 3.748 1.00 0.00 H new ATOM 0 HG2 LYS A 800 6.129 7.667 2.213 1.00 0.00 H new ATOM 0 HG3 LYS A 800 6.030 6.491 0.917 1.00 0.00 H new ATOM 0 HD2 LYS A 800 4.104 5.395 2.055 1.00 0.00 H new ATOM 0 HD3 LYS A 800 4.205 6.565 3.356 1.00 0.00 H new ATOM 0 HE2 LYS A 800 3.899 8.385 1.625 1.00 0.00 H new ATOM 0 HE3 LYS A 800 3.592 7.127 0.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 800 1.518 7.888 1.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 800 1.762 6.336 1.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 800 2.004 7.708 2.889 1.00 0.00 H new ATOM 1445 N GLU A 801 9.008 3.425 3.289 1.00 0.00 N ATOM 1446 CA GLU A 801 9.825 2.713 4.275 1.00 0.00 C ATOM 1447 C GLU A 801 11.284 2.615 3.886 1.00 0.00 C ATOM 1448 O GLU A 801 12.177 3.145 4.546 1.00 0.00 O ATOM 1449 CB GLU A 801 9.321 1.271 4.343 1.00 0.00 C ATOM 1450 CG GLU A 801 8.718 0.859 5.674 1.00 0.00 C ATOM 1451 CD GLU A 801 7.863 1.947 6.296 1.00 0.00 C ATOM 1452 OE1 GLU A 801 6.650 1.988 6.006 1.00 0.00 O ATOM 1453 OE2 GLU A 801 8.408 2.757 7.076 1.00 0.00 O ATOM 0 H GLU A 801 8.472 2.807 2.680 1.00 0.00 H new ATOM 0 HA GLU A 801 9.744 3.265 5.211 1.00 0.00 H new ATOM 0 HB2 GLU A 801 8.573 1.127 3.563 1.00 0.00 H new ATOM 0 HB3 GLU A 801 10.151 0.602 4.116 1.00 0.00 H new ATOM 0 HG2 GLU A 801 8.112 -0.036 5.531 1.00 0.00 H new ATOM 0 HG3 GLU A 801 9.519 0.594 6.364 1.00 0.00 H new ATOM 1460 N TYR A 802 11.480 1.927 2.788 1.00 0.00 N ATOM 1461 CA TYR A 802 12.783 1.646 2.242 1.00 0.00 C ATOM 1462 C TYR A 802 13.347 2.827 1.500 1.00 0.00 C ATOM 1463 O TYR A 802 14.425 3.332 1.816 1.00 0.00 O ATOM 1464 CB TYR A 802 12.604 0.465 1.303 1.00 0.00 C ATOM 1465 CG TYR A 802 13.811 0.020 0.547 1.00 0.00 C ATOM 1466 CD1 TYR A 802 15.092 0.484 0.812 1.00 0.00 C ATOM 1467 CD2 TYR A 802 13.632 -0.879 -0.463 1.00 0.00 C ATOM 1468 CE1 TYR A 802 16.165 0.042 0.068 1.00 0.00 C ATOM 1469 CE2 TYR A 802 14.681 -1.322 -1.210 1.00 0.00 C ATOM 1470 CZ TYR A 802 15.953 -0.863 -0.945 1.00 0.00 C ATOM 1471 OH TYR A 802 17.012 -1.306 -1.696 1.00 0.00 O ATOM 0 H TYR A 802 10.716 1.537 2.235 1.00 0.00 H new ATOM 0 HA TYR A 802 13.490 1.425 3.041 1.00 0.00 H new ATOM 0 HB2 TYR A 802 12.237 -0.380 1.885 1.00 0.00 H new ATOM 0 HB3 TYR A 802 11.826 0.718 0.583 1.00 0.00 H new ATOM 0 HD1 TYR A 802 15.249 1.197 1.608 1.00 0.00 H new ATOM 0 HD2 TYR A 802 12.639 -1.247 -0.675 1.00 0.00 H new ATOM 0 HE1 TYR A 802 17.161 0.403 0.279 1.00 0.00 H new ATOM 0 HE2 TYR A 802 14.516 -2.031 -2.008 1.00 0.00 H new ATOM 0 HH TYR A 802 17.387 -2.114 -1.288 1.00 0.00 H new ATOM 1481 N ASN A 803 12.604 3.255 0.517 1.00 0.00 N ATOM 1482 CA ASN A 803 13.016 4.372 -0.301 1.00 0.00 C ATOM 1483 C ASN A 803 13.082 5.632 0.533 1.00 0.00 C ATOM 1484 O ASN A 803 12.481 5.701 1.603 1.00 0.00 O ATOM 1485 CB ASN A 803 12.026 4.584 -1.449 1.00 0.00 C ATOM 1486 CG ASN A 803 11.609 3.283 -2.109 1.00 0.00 C ATOM 1487 OD1 ASN A 803 12.324 2.284 -2.049 1.00 0.00 O ATOM 1488 ND2 ASN A 803 10.443 3.290 -2.743 1.00 0.00 N ATOM 0 H ASN A 803 11.705 2.848 0.259 1.00 0.00 H new ATOM 0 HA ASN A 803 14.002 4.152 -0.709 1.00 0.00 H new ATOM 0 HB2 ASN A 803 11.141 5.095 -1.070 1.00 0.00 H new ATOM 0 HB3 ASN A 803 12.476 5.238 -2.196 1.00 0.00 H new ATOM 0 HD21 ASN A 803 10.109 2.444 -3.205 1.00 0.00 H new ATOM 0 HD22 ASN A 803 9.881 4.141 -2.768 1.00 0.00 H new ATOM 1495 N PRO A 804 13.929 6.579 0.116 1.00 0.00 N ATOM 1496 CA PRO A 804 14.027 7.900 0.725 1.00 0.00 C ATOM 1497 C PRO A 804 13.156 8.889 -0.056 1.00 0.00 C ATOM 1498 O PRO A 804 13.043 8.766 -1.275 1.00 0.00 O ATOM 1499 CB PRO A 804 15.500 8.228 0.530 1.00 0.00 C ATOM 1500 CG PRO A 804 15.824 7.615 -0.791 1.00 0.00 C ATOM 1501 CD PRO A 804 14.962 6.386 -0.912 1.00 0.00 C ATOM 0 HA PRO A 804 13.700 7.944 1.764 1.00 0.00 H new ATOM 0 HB2 PRO A 804 15.674 9.304 0.526 1.00 0.00 H new ATOM 0 HB3 PRO A 804 16.113 7.809 1.328 1.00 0.00 H new ATOM 0 HG2 PRO A 804 15.621 8.313 -1.603 1.00 0.00 H new ATOM 0 HG3 PRO A 804 16.881 7.355 -0.850 1.00 0.00 H new ATOM 0 HD2 PRO A 804 14.525 6.300 -1.907 1.00 0.00 H new ATOM 0 HD3 PRO A 804 15.536 5.476 -0.736 1.00 0.00 H new ATOM 1509 N PRO A 805 12.517 9.875 0.608 1.00 0.00 N ATOM 1510 CA PRO A 805 11.667 10.853 -0.083 1.00 0.00 C ATOM 1511 C PRO A 805 12.438 11.634 -1.139 1.00 0.00 C ATOM 1512 O PRO A 805 11.898 12.542 -1.770 1.00 0.00 O ATOM 1513 CB PRO A 805 11.219 11.801 1.031 1.00 0.00 C ATOM 1514 CG PRO A 805 11.380 11.019 2.280 1.00 0.00 C ATOM 1515 CD PRO A 805 12.564 10.125 2.054 1.00 0.00 C ATOM 0 HA PRO A 805 10.844 10.368 -0.608 1.00 0.00 H new ATOM 0 HB2 PRO A 805 11.827 12.705 1.049 1.00 0.00 H new ATOM 0 HB3 PRO A 805 10.185 12.115 0.891 1.00 0.00 H new ATOM 0 HG2 PRO A 805 11.544 11.676 3.134 1.00 0.00 H new ATOM 0 HG3 PRO A 805 10.485 10.435 2.494 1.00 0.00 H new ATOM 0 HD2 PRO A 805 13.496 10.607 2.350 1.00 0.00 H new ATOM 0 HD3 PRO A 805 12.487 9.201 2.626 1.00 0.00 H new ATOM 1523 N GLU A 806 13.707 11.275 -1.326 1.00 0.00 N ATOM 1524 CA GLU A 806 14.556 11.959 -2.283 1.00 0.00 C ATOM 1525 C GLU A 806 14.885 11.081 -3.487 1.00 0.00 C ATOM 1526 O GLU A 806 15.273 11.590 -4.539 1.00 0.00 O ATOM 1527 CB GLU A 806 15.849 12.401 -1.606 1.00 0.00 C ATOM 1528 CG GLU A 806 15.630 13.321 -0.416 1.00 0.00 C ATOM 1529 CD GLU A 806 16.924 13.685 0.285 1.00 0.00 C ATOM 1530 OE1 GLU A 806 17.372 12.901 1.148 1.00 0.00 O ATOM 1531 OE2 GLU A 806 17.488 14.755 -0.028 1.00 0.00 O ATOM 0 H GLU A 806 14.164 10.514 -0.824 1.00 0.00 H new ATOM 0 HA GLU A 806 14.007 12.828 -2.644 1.00 0.00 H new ATOM 0 HB2 GLU A 806 16.396 11.518 -1.276 1.00 0.00 H new ATOM 0 HB3 GLU A 806 16.476 12.910 -2.337 1.00 0.00 H new ATOM 0 HG2 GLU A 806 15.134 14.232 -0.752 1.00 0.00 H new ATOM 0 HG3 GLU A 806 14.960 12.837 0.294 1.00 0.00 H new ATOM 1538 N SER A 807 14.736 9.766 -3.337 1.00 0.00 N ATOM 1539 CA SER A 807 15.035 8.851 -4.434 1.00 0.00 C ATOM 1540 C SER A 807 14.151 9.162 -5.616 1.00 0.00 C ATOM 1541 O SER A 807 14.609 9.693 -6.629 1.00 0.00 O ATOM 1542 CB SER A 807 14.825 7.404 -4.016 1.00 0.00 C ATOM 1543 OG SER A 807 14.887 6.535 -5.133 1.00 0.00 O ATOM 0 H SER A 807 14.415 9.316 -2.480 1.00 0.00 H new ATOM 0 HA SER A 807 16.082 8.984 -4.708 1.00 0.00 H new ATOM 0 HB2 SER A 807 15.584 7.119 -3.287 1.00 0.00 H new ATOM 0 HB3 SER A 807 13.857 7.301 -3.525 1.00 0.00 H new ATOM 0 HG SER A 807 14.919 5.606 -4.823 1.00 0.00 H new ATOM 1549 N GLU A 808 12.875 8.842 -5.456 1.00 0.00 N ATOM 1550 CA GLU A 808 11.884 9.063 -6.488 1.00 0.00 C ATOM 1551 C GLU A 808 10.590 8.345 -6.137 1.00 0.00 C ATOM 1552 O GLU A 808 9.558 8.977 -5.915 1.00 0.00 O ATOM 1553 CB GLU A 808 12.406 8.562 -7.839 1.00 0.00 C ATOM 1554 CG GLU A 808 11.313 8.209 -8.828 1.00 0.00 C ATOM 1555 CD GLU A 808 10.480 9.407 -9.244 1.00 0.00 C ATOM 1556 OE1 GLU A 808 9.745 9.949 -8.392 1.00 0.00 O ATOM 1557 OE2 GLU A 808 10.565 9.807 -10.424 1.00 0.00 O ATOM 0 H GLU A 808 12.502 8.422 -4.605 1.00 0.00 H new ATOM 0 HA GLU A 808 11.688 10.133 -6.558 1.00 0.00 H new ATOM 0 HB2 GLU A 808 13.045 9.329 -8.277 1.00 0.00 H new ATOM 0 HB3 GLU A 808 13.030 7.684 -7.673 1.00 0.00 H new ATOM 0 HG2 GLU A 808 11.763 7.761 -9.714 1.00 0.00 H new ATOM 0 HG3 GLU A 808 10.661 7.456 -8.387 1.00 0.00 H new ATOM 1564 N TYR A 809 10.671 7.020 -6.055 1.00 0.00 N ATOM 1565 CA TYR A 809 9.503 6.195 -5.766 1.00 0.00 C ATOM 1566 C TYR A 809 8.836 6.616 -4.476 1.00 0.00 C ATOM 1567 O TYR A 809 7.613 6.714 -4.414 1.00 0.00 O ATOM 1568 CB TYR A 809 9.856 4.730 -5.690 1.00 0.00 C ATOM 1569 CG TYR A 809 11.103 4.379 -6.433 1.00 0.00 C ATOM 1570 CD1 TYR A 809 11.413 4.904 -7.677 1.00 0.00 C ATOM 1571 CD2 TYR A 809 11.988 3.552 -5.839 1.00 0.00 C ATOM 1572 CE1 TYR A 809 12.598 4.579 -8.299 1.00 0.00 C ATOM 1573 CE2 TYR A 809 13.169 3.222 -6.423 1.00 0.00 C ATOM 1574 CZ TYR A 809 13.479 3.736 -7.664 1.00 0.00 C ATOM 1575 OH TYR A 809 14.665 3.420 -8.268 1.00 0.00 O ATOM 0 H TYR A 809 11.535 6.494 -6.185 1.00 0.00 H new ATOM 0 HA TYR A 809 8.808 6.344 -6.592 1.00 0.00 H new ATOM 0 HB2 TYR A 809 9.974 4.446 -4.644 1.00 0.00 H new ATOM 0 HB3 TYR A 809 9.028 4.144 -6.088 1.00 0.00 H new ATOM 0 HD1 TYR A 809 10.719 5.574 -8.163 1.00 0.00 H new ATOM 0 HD2 TYR A 809 11.750 3.140 -4.870 1.00 0.00 H new ATOM 0 HE1 TYR A 809 12.832 4.981 -9.273 1.00 0.00 H new ATOM 0 HE2 TYR A 809 13.860 2.562 -5.919 1.00 0.00 H new ATOM 0 HH TYR A 809 14.488 2.982 -9.127 1.00 0.00 H new ATOM 1585 N TYR A 810 9.644 6.840 -3.441 1.00 0.00 N ATOM 1586 CA TYR A 810 9.118 7.266 -2.154 1.00 0.00 C ATOM 1587 C TYR A 810 8.041 8.319 -2.369 1.00 0.00 C ATOM 1588 O TYR A 810 6.931 8.217 -1.853 1.00 0.00 O ATOM 1589 CB TYR A 810 10.243 7.839 -1.280 1.00 0.00 C ATOM 1590 CG TYR A 810 9.845 8.048 0.164 1.00 0.00 C ATOM 1591 CD1 TYR A 810 8.657 8.646 0.489 1.00 0.00 C ATOM 1592 CD2 TYR A 810 10.653 7.626 1.193 1.00 0.00 C ATOM 1593 CE1 TYR A 810 8.279 8.821 1.799 1.00 0.00 C ATOM 1594 CE2 TYR A 810 10.295 7.796 2.512 1.00 0.00 C ATOM 1595 CZ TYR A 810 9.101 8.395 2.813 1.00 0.00 C ATOM 1596 OH TYR A 810 8.725 8.568 4.125 1.00 0.00 O ATOM 0 H TYR A 810 10.658 6.733 -3.472 1.00 0.00 H new ATOM 0 HA TYR A 810 8.687 6.405 -1.644 1.00 0.00 H new ATOM 0 HB2 TYR A 810 11.099 7.165 -1.318 1.00 0.00 H new ATOM 0 HB3 TYR A 810 10.568 8.791 -1.700 1.00 0.00 H new ATOM 0 HD1 TYR A 810 8.003 8.987 -0.300 1.00 0.00 H new ATOM 0 HD2 TYR A 810 11.593 7.148 0.961 1.00 0.00 H new ATOM 0 HE1 TYR A 810 7.336 9.293 2.031 1.00 0.00 H new ATOM 0 HE2 TYR A 810 10.950 7.460 3.302 1.00 0.00 H new ATOM 0 HH TYR A 810 9.421 8.209 4.715 1.00 0.00 H new ATOM 1606 N LYS A 811 8.383 9.331 -3.134 1.00 0.00 N ATOM 1607 CA LYS A 811 7.453 10.402 -3.431 1.00 0.00 C ATOM 1608 C LYS A 811 6.238 9.848 -4.127 1.00 0.00 C ATOM 1609 O LYS A 811 5.121 10.023 -3.665 1.00 0.00 O ATOM 1610 CB LYS A 811 8.133 11.415 -4.331 1.00 0.00 C ATOM 1611 CG LYS A 811 9.552 11.679 -3.910 1.00 0.00 C ATOM 1612 CD LYS A 811 10.197 12.766 -4.744 1.00 0.00 C ATOM 1613 CE LYS A 811 10.217 12.361 -6.198 1.00 0.00 C ATOM 1614 NZ LYS A 811 9.939 13.507 -7.107 1.00 0.00 N ATOM 0 H LYS A 811 9.302 9.437 -3.564 1.00 0.00 H new ATOM 0 HA LYS A 811 7.144 10.881 -2.502 1.00 0.00 H new ATOM 0 HB2 LYS A 811 8.121 11.052 -5.359 1.00 0.00 H new ATOM 0 HB3 LYS A 811 7.571 12.349 -4.316 1.00 0.00 H new ATOM 0 HG2 LYS A 811 9.571 11.969 -2.859 1.00 0.00 H new ATOM 0 HG3 LYS A 811 10.133 10.761 -3.998 1.00 0.00 H new ATOM 0 HD2 LYS A 811 9.647 13.700 -4.626 1.00 0.00 H new ATOM 0 HD3 LYS A 811 11.213 12.948 -4.395 1.00 0.00 H new ATOM 0 HE2 LYS A 811 11.190 11.935 -6.441 1.00 0.00 H new ATOM 0 HE3 LYS A 811 9.476 11.579 -6.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 811 9.963 13.181 -8.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 811 8.999 13.898 -6.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 811 10.660 14.243 -6.968 1.00 0.00 H new ATOM 1628 N CYS A 812 6.476 9.189 -5.252 1.00 0.00 N ATOM 1629 CA CYS A 812 5.405 8.585 -6.028 1.00 0.00 C ATOM 1630 C CYS A 812 4.474 7.806 -5.122 1.00 0.00 C ATOM 1631 O CYS A 812 3.301 7.647 -5.401 1.00 0.00 O ATOM 1632 CB CYS A 812 5.970 7.650 -7.085 1.00 0.00 C ATOM 1633 SG CYS A 812 7.632 8.061 -7.653 1.00 0.00 S ATOM 0 H CYS A 812 7.407 9.059 -5.648 1.00 0.00 H new ATOM 0 HA CYS A 812 4.851 9.386 -6.518 1.00 0.00 H new ATOM 0 HB2 CYS A 812 5.979 6.636 -6.685 1.00 0.00 H new ATOM 0 HB3 CYS A 812 5.299 7.648 -7.944 1.00 0.00 H new ATOM 0 HG CYS A 812 8.376 8.367 -6.632 1.00 0.00 H new ATOM 1639 N ALA A 813 5.034 7.296 -4.056 1.00 0.00 N ATOM 1640 CA ALA A 813 4.271 6.548 -3.066 1.00 0.00 C ATOM 1641 C ALA A 813 3.297 7.473 -2.368 1.00 0.00 C ATOM 1642 O ALA A 813 2.120 7.172 -2.254 1.00 0.00 O ATOM 1643 CB ALA A 813 5.202 5.883 -2.068 1.00 0.00 C ATOM 0 H ALA A 813 6.028 7.382 -3.842 1.00 0.00 H new ATOM 0 HA ALA A 813 3.706 5.762 -3.568 1.00 0.00 H new ATOM 0 HB1 ALA A 813 4.615 5.329 -1.336 1.00 0.00 H new ATOM 0 HB2 ALA A 813 5.868 5.198 -2.592 1.00 0.00 H new ATOM 0 HB3 ALA A 813 5.792 6.644 -1.558 1.00 0.00 H new ATOM 1649 N ASN A 814 3.811 8.601 -1.912 1.00 0.00 N ATOM 1650 CA ASN A 814 3.020 9.615 -1.253 1.00 0.00 C ATOM 1651 C ASN A 814 1.992 10.182 -2.232 1.00 0.00 C ATOM 1652 O ASN A 814 0.822 10.393 -1.904 1.00 0.00 O ATOM 1653 CB ASN A 814 3.960 10.720 -0.809 1.00 0.00 C ATOM 1654 CG ASN A 814 3.322 11.686 0.171 1.00 0.00 C ATOM 1655 OD1 ASN A 814 2.111 11.910 0.142 1.00 0.00 O ATOM 1656 ND2 ASN A 814 4.137 12.266 1.045 1.00 0.00 N ATOM 0 H ASN A 814 4.800 8.838 -1.991 1.00 0.00 H new ATOM 0 HA ASN A 814 2.494 9.192 -0.397 1.00 0.00 H new ATOM 0 HB2 ASN A 814 4.842 10.275 -0.349 1.00 0.00 H new ATOM 0 HB3 ASN A 814 4.301 11.272 -1.685 1.00 0.00 H new ATOM 0 HD21 ASN A 814 3.766 12.926 1.728 1.00 0.00 H new ATOM 0 HD22 ASN A 814 5.134 12.051 1.033 1.00 0.00 H new ATOM 1663 N ILE A 815 2.469 10.394 -3.451 1.00 0.00 N ATOM 1664 CA ILE A 815 1.673 10.936 -4.543 1.00 0.00 C ATOM 1665 C ILE A 815 0.542 9.991 -4.872 1.00 0.00 C ATOM 1666 O ILE A 815 -0.630 10.359 -4.856 1.00 0.00 O ATOM 1667 CB ILE A 815 2.556 11.144 -5.776 1.00 0.00 C ATOM 1668 CG1 ILE A 815 3.365 12.417 -5.611 1.00 0.00 C ATOM 1669 CG2 ILE A 815 1.731 11.185 -7.043 1.00 0.00 C ATOM 1670 CD1 ILE A 815 4.795 12.254 -6.024 1.00 0.00 C ATOM 0 H ILE A 815 3.434 10.191 -3.713 1.00 0.00 H new ATOM 0 HA ILE A 815 1.256 11.896 -4.239 1.00 0.00 H new ATOM 0 HB ILE A 815 3.238 10.298 -5.865 1.00 0.00 H new ATOM 0 HG12 ILE A 815 2.909 13.211 -6.203 1.00 0.00 H new ATOM 0 HG13 ILE A 815 3.327 12.734 -4.569 1.00 0.00 H new ATOM 0 HG21 ILE A 815 2.388 11.334 -7.900 1.00 0.00 H new ATOM 0 HG22 ILE A 815 1.193 10.244 -7.157 1.00 0.00 H new ATOM 0 HG23 ILE A 815 1.017 12.007 -6.986 1.00 0.00 H new ATOM 0 HD11 ILE A 815 5.324 13.197 -5.884 1.00 0.00 H new ATOM 0 HD12 ILE A 815 5.264 11.481 -5.415 1.00 0.00 H new ATOM 0 HD13 ILE A 815 4.840 11.965 -7.074 1.00 0.00 H new ATOM 1682 N LEU A 816 0.923 8.776 -5.202 1.00 0.00 N ATOM 1683 CA LEU A 816 -0.020 7.726 -5.491 1.00 0.00 C ATOM 1684 C LEU A 816 -0.982 7.626 -4.336 1.00 0.00 C ATOM 1685 O LEU A 816 -2.179 7.780 -4.494 1.00 0.00 O ATOM 1686 CB LEU A 816 0.717 6.405 -5.653 1.00 0.00 C ATOM 1687 CG LEU A 816 0.070 5.409 -6.582 1.00 0.00 C ATOM 1688 CD1 LEU A 816 0.856 4.135 -6.586 1.00 0.00 C ATOM 1689 CD2 LEU A 816 -1.344 5.181 -6.167 1.00 0.00 C ATOM 0 H LEU A 816 1.900 8.491 -5.277 1.00 0.00 H new ATOM 0 HA LEU A 816 -0.557 7.947 -6.414 1.00 0.00 H new ATOM 0 HB2 LEU A 816 1.724 6.613 -6.016 1.00 0.00 H new ATOM 0 HB3 LEU A 816 0.821 5.944 -4.671 1.00 0.00 H new ATOM 0 HG LEU A 816 0.063 5.801 -7.599 1.00 0.00 H new ATOM 0 HD11 LEU A 816 0.384 3.419 -7.259 1.00 0.00 H new ATOM 0 HD12 LEU A 816 1.873 4.336 -6.924 1.00 0.00 H new ATOM 0 HD13 LEU A 816 0.884 3.722 -5.578 1.00 0.00 H new ATOM 0 HD21 LEU A 816 -1.809 4.461 -6.840 1.00 0.00 H new ATOM 0 HD22 LEU A 816 -1.366 4.793 -5.149 1.00 0.00 H new ATOM 0 HD23 LEU A 816 -1.892 6.123 -6.208 1.00 0.00 H new ATOM 1701 N GLU A 817 -0.422 7.401 -3.166 1.00 0.00 N ATOM 1702 CA GLU A 817 -1.192 7.290 -1.946 1.00 0.00 C ATOM 1703 C GLU A 817 -2.269 8.386 -1.887 1.00 0.00 C ATOM 1704 O GLU A 817 -3.329 8.213 -1.302 1.00 0.00 O ATOM 1705 CB GLU A 817 -0.240 7.419 -0.759 1.00 0.00 C ATOM 1706 CG GLU A 817 -0.840 6.983 0.567 1.00 0.00 C ATOM 1707 CD GLU A 817 -1.326 8.154 1.400 1.00 0.00 C ATOM 1708 OE1 GLU A 817 -2.504 8.538 1.253 1.00 0.00 O ATOM 1709 OE2 GLU A 817 -0.526 8.685 2.199 1.00 0.00 O ATOM 0 H GLU A 817 0.583 7.290 -3.034 1.00 0.00 H new ATOM 0 HA GLU A 817 -1.695 6.324 -1.916 1.00 0.00 H new ATOM 0 HB2 GLU A 817 0.652 6.824 -0.956 1.00 0.00 H new ATOM 0 HB3 GLU A 817 0.082 8.457 -0.676 1.00 0.00 H new ATOM 0 HG2 GLU A 817 -1.673 6.305 0.379 1.00 0.00 H new ATOM 0 HG3 GLU A 817 -0.095 6.424 1.133 1.00 0.00 H new ATOM 1716 N LYS A 818 -1.971 9.524 -2.492 1.00 0.00 N ATOM 1717 CA LYS A 818 -2.873 10.644 -2.556 1.00 0.00 C ATOM 1718 C LYS A 818 -3.932 10.434 -3.652 1.00 0.00 C ATOM 1719 O LYS A 818 -5.131 10.504 -3.381 1.00 0.00 O ATOM 1720 CB LYS A 818 -1.991 11.832 -2.781 1.00 0.00 C ATOM 1721 CG LYS A 818 -2.466 12.751 -3.836 1.00 0.00 C ATOM 1722 CD LYS A 818 -1.299 13.466 -4.488 1.00 0.00 C ATOM 1723 CE LYS A 818 -1.389 13.379 -5.996 1.00 0.00 C ATOM 1724 NZ LYS A 818 -2.619 14.034 -6.521 1.00 0.00 N ATOM 0 H LYS A 818 -1.079 9.690 -2.958 1.00 0.00 H new ATOM 0 HA LYS A 818 -3.459 10.778 -1.647 1.00 0.00 H new ATOM 0 HB2 LYS A 818 -1.902 12.386 -1.846 1.00 0.00 H new ATOM 0 HB3 LYS A 818 -0.992 11.484 -3.042 1.00 0.00 H new ATOM 0 HG2 LYS A 818 -3.023 12.192 -4.588 1.00 0.00 H new ATOM 0 HG3 LYS A 818 -3.153 13.481 -3.407 1.00 0.00 H new ATOM 0 HD2 LYS A 818 -1.289 14.511 -4.180 1.00 0.00 H new ATOM 0 HD3 LYS A 818 -0.362 13.025 -4.149 1.00 0.00 H new ATOM 0 HE2 LYS A 818 -0.511 13.849 -6.439 1.00 0.00 H new ATOM 0 HE3 LYS A 818 -1.378 12.332 -6.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 818 -2.553 14.118 -7.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 818 -3.451 13.461 -6.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 818 -2.713 14.981 -6.103 1.00 0.00 H new ATOM 1738 N PHE A 819 -3.487 10.181 -4.887 1.00 0.00 N ATOM 1739 CA PHE A 819 -4.404 9.910 -5.997 1.00 0.00 C ATOM 1740 C PHE A 819 -5.273 8.739 -5.586 1.00 0.00 C ATOM 1741 O PHE A 819 -6.502 8.808 -5.606 1.00 0.00 O ATOM 1742 CB PHE A 819 -3.581 9.597 -7.257 1.00 0.00 C ATOM 1743 CG PHE A 819 -4.262 8.804 -8.358 1.00 0.00 C ATOM 1744 CD1 PHE A 819 -4.738 7.515 -8.145 1.00 0.00 C ATOM 1745 CD2 PHE A 819 -4.357 9.335 -9.635 1.00 0.00 C ATOM 1746 CE1 PHE A 819 -5.291 6.782 -9.160 1.00 0.00 C ATOM 1747 CE2 PHE A 819 -4.925 8.605 -10.664 1.00 0.00 C ATOM 1748 CZ PHE A 819 -5.391 7.326 -10.427 1.00 0.00 C ATOM 0 H PHE A 819 -2.500 10.158 -5.142 1.00 0.00 H new ATOM 0 HA PHE A 819 -5.040 10.766 -6.223 1.00 0.00 H new ATOM 0 HB2 PHE A 819 -3.244 10.542 -7.682 1.00 0.00 H new ATOM 0 HB3 PHE A 819 -2.690 9.050 -6.950 1.00 0.00 H new ATOM 0 HD1 PHE A 819 -4.670 7.083 -7.158 1.00 0.00 H new ATOM 0 HD2 PHE A 819 -3.983 10.330 -9.829 1.00 0.00 H new ATOM 0 HE1 PHE A 819 -5.649 5.781 -8.971 1.00 0.00 H new ATOM 0 HE2 PHE A 819 -5.004 9.035 -11.652 1.00 0.00 H new ATOM 0 HZ PHE A 819 -5.832 6.753 -11.229 1.00 0.00 H new ATOM 1758 N PHE A 820 -4.593 7.651 -5.250 1.00 0.00 N ATOM 1759 CA PHE A 820 -5.225 6.453 -4.752 1.00 0.00 C ATOM 1760 C PHE A 820 -6.268 6.854 -3.741 1.00 0.00 C ATOM 1761 O PHE A 820 -7.398 6.406 -3.832 1.00 0.00 O ATOM 1762 CB PHE A 820 -4.146 5.533 -4.184 1.00 0.00 C ATOM 1763 CG PHE A 820 -4.431 4.868 -2.885 1.00 0.00 C ATOM 1764 CD1 PHE A 820 -5.009 3.660 -2.904 1.00 0.00 C ATOM 1765 CD2 PHE A 820 -4.050 5.399 -1.677 1.00 0.00 C ATOM 1766 CE1 PHE A 820 -5.230 2.953 -1.773 1.00 0.00 C ATOM 1767 CE2 PHE A 820 -4.282 4.700 -0.505 1.00 0.00 C ATOM 1768 CZ PHE A 820 -4.877 3.462 -0.563 1.00 0.00 C ATOM 0 H PHE A 820 -3.578 7.582 -5.319 1.00 0.00 H new ATOM 0 HA PHE A 820 -5.735 5.896 -5.538 1.00 0.00 H new ATOM 0 HB2 PHE A 820 -3.941 4.757 -4.922 1.00 0.00 H new ATOM 0 HB3 PHE A 820 -3.231 6.115 -4.071 1.00 0.00 H new ATOM 0 HD1 PHE A 820 -5.308 3.238 -3.852 1.00 0.00 H new ATOM 0 HD2 PHE A 820 -3.568 6.365 -1.641 1.00 0.00 H new ATOM 0 HE1 PHE A 820 -5.690 1.978 -1.831 1.00 0.00 H new ATOM 0 HE2 PHE A 820 -3.998 5.124 0.447 1.00 0.00 H new ATOM 0 HZ PHE A 820 -5.062 2.901 0.341 1.00 0.00 H new ATOM 1778 N PHE A 821 -5.905 7.762 -2.828 1.00 0.00 N ATOM 1779 CA PHE A 821 -6.852 8.227 -1.824 1.00 0.00 C ATOM 1780 C PHE A 821 -8.121 8.775 -2.449 1.00 0.00 C ATOM 1781 O PHE A 821 -9.209 8.564 -1.926 1.00 0.00 O ATOM 1782 CB PHE A 821 -6.213 9.229 -0.874 1.00 0.00 C ATOM 1783 CG PHE A 821 -6.040 8.617 0.476 1.00 0.00 C ATOM 1784 CD1 PHE A 821 -5.291 7.480 0.573 1.00 0.00 C ATOM 1785 CD2 PHE A 821 -6.672 9.108 1.605 1.00 0.00 C ATOM 1786 CE1 PHE A 821 -5.147 6.812 1.763 1.00 0.00 C ATOM 1787 CE2 PHE A 821 -6.527 8.459 2.822 1.00 0.00 C ATOM 1788 CZ PHE A 821 -5.762 7.303 2.900 1.00 0.00 C ATOM 0 H PHE A 821 -4.977 8.180 -2.768 1.00 0.00 H new ATOM 0 HA PHE A 821 -7.142 7.358 -1.233 1.00 0.00 H new ATOM 0 HB2 PHE A 821 -5.246 9.547 -1.264 1.00 0.00 H new ATOM 0 HB3 PHE A 821 -6.836 10.121 -0.801 1.00 0.00 H new ATOM 0 HD1 PHE A 821 -4.799 7.097 -0.309 1.00 0.00 H new ATOM 0 HD2 PHE A 821 -7.279 9.998 1.538 1.00 0.00 H new ATOM 0 HE1 PHE A 821 -4.557 5.909 1.811 1.00 0.00 H new ATOM 0 HE2 PHE A 821 -7.008 8.851 3.706 1.00 0.00 H new ATOM 0 HZ PHE A 821 -5.648 6.790 3.844 1.00 0.00 H new ATOM 1798 N SER A 822 -7.988 9.459 -3.572 1.00 0.00 N ATOM 1799 CA SER A 822 -9.150 10.003 -4.257 1.00 0.00 C ATOM 1800 C SER A 822 -9.957 8.885 -4.920 1.00 0.00 C ATOM 1801 O SER A 822 -11.152 9.030 -5.148 1.00 0.00 O ATOM 1802 CB SER A 822 -8.720 11.033 -5.303 1.00 0.00 C ATOM 1803 OG SER A 822 -7.957 12.070 -4.713 1.00 0.00 O ATOM 0 H SER A 822 -7.095 9.650 -4.027 1.00 0.00 H new ATOM 0 HA SER A 822 -9.782 10.496 -3.518 1.00 0.00 H new ATOM 0 HB2 SER A 822 -8.134 10.543 -6.081 1.00 0.00 H new ATOM 0 HB3 SER A 822 -9.601 11.455 -5.786 1.00 0.00 H new ATOM 0 HG SER A 822 -7.693 12.715 -5.402 1.00 0.00 H new ATOM 1809 N LYS A 823 -9.288 7.769 -5.208 1.00 0.00 N ATOM 1810 CA LYS A 823 -9.913 6.612 -5.864 1.00 0.00 C ATOM 1811 C LYS A 823 -10.653 5.719 -4.886 1.00 0.00 C ATOM 1812 O LYS A 823 -11.709 5.169 -5.199 1.00 0.00 O ATOM 1813 CB LYS A 823 -8.838 5.806 -6.575 1.00 0.00 C ATOM 1814 CG LYS A 823 -8.069 6.604 -7.612 1.00 0.00 C ATOM 1815 CD LYS A 823 -8.922 7.696 -8.231 1.00 0.00 C ATOM 1816 CE LYS A 823 -8.567 7.950 -9.682 1.00 0.00 C ATOM 1817 NZ LYS A 823 -7.834 9.234 -9.859 1.00 0.00 N ATOM 0 H LYS A 823 -8.299 7.638 -4.995 1.00 0.00 H new ATOM 0 HA LYS A 823 -10.648 6.990 -6.575 1.00 0.00 H new ATOM 0 HB2 LYS A 823 -8.138 5.417 -5.835 1.00 0.00 H new ATOM 0 HB3 LYS A 823 -9.301 4.946 -7.060 1.00 0.00 H new ATOM 0 HG2 LYS A 823 -7.189 7.050 -7.148 1.00 0.00 H new ATOM 0 HG3 LYS A 823 -7.712 5.934 -8.394 1.00 0.00 H new ATOM 0 HD2 LYS A 823 -9.973 7.417 -8.160 1.00 0.00 H new ATOM 0 HD3 LYS A 823 -8.798 8.617 -7.662 1.00 0.00 H new ATOM 0 HE2 LYS A 823 -7.955 7.129 -10.055 1.00 0.00 H new ATOM 0 HE3 LYS A 823 -9.478 7.967 -10.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 823 -8.121 9.677 -10.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 823 -8.058 9.873 -9.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 823 -6.811 9.050 -9.876 1.00 0.00 H new ATOM 1831 N ILE A 824 -10.096 5.580 -3.707 1.00 0.00 N ATOM 1832 CA ILE A 824 -10.696 4.762 -2.674 1.00 0.00 C ATOM 1833 C ILE A 824 -11.880 5.517 -2.131 1.00 0.00 C ATOM 1834 O ILE A 824 -12.984 4.999 -2.019 1.00 0.00 O ATOM 1835 CB ILE A 824 -9.709 4.495 -1.551 1.00 0.00 C ATOM 1836 CG1 ILE A 824 -8.675 5.561 -1.535 1.00 0.00 C ATOM 1837 CG2 ILE A 824 -9.063 3.145 -1.725 1.00 0.00 C ATOM 1838 CD1 ILE A 824 -7.529 5.273 -0.637 1.00 0.00 C ATOM 0 H ILE A 824 -9.220 6.026 -3.435 1.00 0.00 H new ATOM 0 HA ILE A 824 -10.996 3.801 -3.091 1.00 0.00 H new ATOM 0 HB ILE A 824 -10.244 4.498 -0.601 1.00 0.00 H new ATOM 0 HG12 ILE A 824 -8.302 5.707 -2.549 1.00 0.00 H new ATOM 0 HG13 ILE A 824 -9.138 6.499 -1.228 1.00 0.00 H new ATOM 0 HG21 ILE A 824 -8.359 2.971 -0.911 1.00 0.00 H new ATOM 0 HG22 ILE A 824 -9.830 2.370 -1.713 1.00 0.00 H new ATOM 0 HG23 ILE A 824 -8.532 3.116 -2.677 1.00 0.00 H new ATOM 0 HD11 ILE A 824 -6.817 6.097 -0.680 1.00 0.00 H new ATOM 0 HD12 ILE A 824 -7.888 5.157 0.386 1.00 0.00 H new ATOM 0 HD13 ILE A 824 -7.039 4.353 -0.956 1.00 0.00 H new ATOM 1850 N LYS A 825 -11.621 6.784 -1.850 1.00 0.00 N ATOM 1851 CA LYS A 825 -12.630 7.683 -1.333 1.00 0.00 C ATOM 1852 C LYS A 825 -13.830 7.654 -2.249 1.00 0.00 C ATOM 1853 O LYS A 825 -14.973 7.477 -1.826 1.00 0.00 O ATOM 1854 CB LYS A 825 -12.104 9.106 -1.290 1.00 0.00 C ATOM 1855 CG LYS A 825 -12.058 9.676 0.107 1.00 0.00 C ATOM 1856 CD LYS A 825 -11.438 11.049 0.129 1.00 0.00 C ATOM 1857 CE LYS A 825 -9.935 10.951 -0.013 1.00 0.00 C ATOM 1858 NZ LYS A 825 -9.349 12.160 -0.653 1.00 0.00 N ATOM 0 H LYS A 825 -10.705 7.214 -1.975 1.00 0.00 H new ATOM 0 HA LYS A 825 -12.898 7.363 -0.326 1.00 0.00 H new ATOM 0 HB2 LYS A 825 -11.103 9.130 -1.720 1.00 0.00 H new ATOM 0 HB3 LYS A 825 -12.734 9.739 -1.914 1.00 0.00 H new ATOM 0 HG2 LYS A 825 -13.068 9.727 0.513 1.00 0.00 H new ATOM 0 HG3 LYS A 825 -11.488 9.009 0.754 1.00 0.00 H new ATOM 0 HD2 LYS A 825 -11.848 11.653 -0.681 1.00 0.00 H new ATOM 0 HD3 LYS A 825 -11.689 11.554 1.062 1.00 0.00 H new ATOM 0 HE2 LYS A 825 -9.488 10.810 0.971 1.00 0.00 H new ATOM 0 HE3 LYS A 825 -9.685 10.071 -0.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 825 -8.318 12.047 -0.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 825 -9.755 12.281 -1.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 825 -9.564 12.997 -0.075 1.00 0.00 H new ATOM 1872 N GLU A 826 -13.523 7.840 -3.526 1.00 0.00 N ATOM 1873 CA GLU A 826 -14.519 7.848 -4.578 1.00 0.00 C ATOM 1874 C GLU A 826 -15.298 6.555 -4.563 1.00 0.00 C ATOM 1875 O GLU A 826 -16.507 6.533 -4.794 1.00 0.00 O ATOM 1876 CB GLU A 826 -13.831 8.036 -5.939 1.00 0.00 C ATOM 1877 CG GLU A 826 -13.687 6.762 -6.758 1.00 0.00 C ATOM 1878 CD GLU A 826 -14.955 6.387 -7.501 1.00 0.00 C ATOM 1879 OE1 GLU A 826 -15.356 7.144 -8.411 1.00 0.00 O ATOM 1880 OE2 GLU A 826 -15.545 5.334 -7.178 1.00 0.00 O ATOM 0 H GLU A 826 -12.570 7.990 -3.858 1.00 0.00 H new ATOM 0 HA GLU A 826 -15.210 8.674 -4.411 1.00 0.00 H new ATOM 0 HB2 GLU A 826 -14.398 8.764 -6.520 1.00 0.00 H new ATOM 0 HB3 GLU A 826 -12.841 8.461 -5.775 1.00 0.00 H new ATOM 0 HG2 GLU A 826 -12.876 6.888 -7.475 1.00 0.00 H new ATOM 0 HG3 GLU A 826 -13.404 5.942 -6.098 1.00 0.00 H new ATOM 1887 N ALA A 827 -14.588 5.476 -4.287 1.00 0.00 N ATOM 1888 CA ALA A 827 -15.194 4.167 -4.273 1.00 0.00 C ATOM 1889 C ALA A 827 -15.671 3.742 -2.885 1.00 0.00 C ATOM 1890 O ALA A 827 -15.844 2.554 -2.634 1.00 0.00 O ATOM 1891 CB ALA A 827 -14.204 3.169 -4.823 1.00 0.00 C ATOM 0 H ALA A 827 -13.591 5.486 -4.070 1.00 0.00 H new ATOM 0 HA ALA A 827 -16.087 4.204 -4.897 1.00 0.00 H new ATOM 0 HB1 ALA A 827 -14.649 2.174 -4.818 1.00 0.00 H new ATOM 0 HB2 ALA A 827 -13.940 3.443 -5.844 1.00 0.00 H new ATOM 0 HB3 ALA A 827 -13.307 3.168 -4.204 1.00 0.00 H new ATOM 1897 N GLY A 828 -15.905 4.706 -1.997 1.00 0.00 N ATOM 1898 CA GLY A 828 -16.360 4.377 -0.653 1.00 0.00 C ATOM 1899 C GLY A 828 -15.455 3.370 0.024 1.00 0.00 C ATOM 1900 O GLY A 828 -15.916 2.466 0.720 1.00 0.00 O ATOM 0 H GLY A 828 -15.789 5.703 -2.181 1.00 0.00 H new ATOM 0 HA2 GLY A 828 -16.403 5.286 -0.053 1.00 0.00 H new ATOM 0 HA3 GLY A 828 -17.373 3.978 -0.701 1.00 0.00 H new ATOM 1904 N LEU A 829 -14.161 3.547 -0.175 1.00 0.00 N ATOM 1905 CA LEU A 829 -13.153 2.659 0.373 1.00 0.00 C ATOM 1906 C LEU A 829 -12.720 3.138 1.745 1.00 0.00 C ATOM 1907 O LEU A 829 -13.456 2.972 2.717 1.00 0.00 O ATOM 1908 CB LEU A 829 -11.988 2.611 -0.612 1.00 0.00 C ATOM 1909 CG LEU A 829 -12.362 2.024 -1.978 1.00 0.00 C ATOM 1910 CD1 LEU A 829 -11.212 1.315 -2.621 1.00 0.00 C ATOM 1911 CD2 LEU A 829 -13.531 1.065 -1.873 1.00 0.00 C ATOM 0 H LEU A 829 -13.778 4.316 -0.725 1.00 0.00 H new ATOM 0 HA LEU A 829 -13.550 1.653 0.506 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -11.601 3.620 -0.753 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -11.182 2.018 -0.180 1.00 0.00 H new ATOM 0 HG LEU A 829 -12.645 2.873 -2.600 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -11.524 0.916 -3.586 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -10.389 2.014 -2.767 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -10.884 0.497 -1.979 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -13.767 0.669 -2.861 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -13.269 0.243 -1.206 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -14.399 1.591 -1.476 1.00 0.00 H new ATOM 1923 N ILE A 830 -11.536 3.745 1.802 1.00 0.00 N ATOM 1924 CA ILE A 830 -10.973 4.303 3.012 1.00 0.00 C ATOM 1925 C ILE A 830 -11.820 4.044 4.272 1.00 0.00 C ATOM 1926 O ILE A 830 -11.969 2.891 4.680 1.00 0.00 O ATOM 1927 CB ILE A 830 -10.723 5.786 2.750 1.00 0.00 C ATOM 1928 CG1 ILE A 830 -10.718 5.993 1.247 1.00 0.00 C ATOM 1929 CG2 ILE A 830 -9.386 6.192 3.306 1.00 0.00 C ATOM 1930 CD1 ILE A 830 -9.971 7.207 0.801 1.00 0.00 C ATOM 0 H ILE A 830 -10.935 3.861 0.986 1.00 0.00 H new ATOM 0 HA ILE A 830 -10.035 3.798 3.242 1.00 0.00 H new ATOM 0 HB ILE A 830 -11.497 6.386 3.227 1.00 0.00 H new ATOM 0 HG12 ILE A 830 -10.280 5.115 0.772 1.00 0.00 H new ATOM 0 HG13 ILE A 830 -11.748 6.065 0.897 1.00 0.00 H new ATOM 0 HG21 ILE A 830 -9.218 7.252 3.113 1.00 0.00 H new ATOM 0 HG22 ILE A 830 -9.369 6.011 4.381 1.00 0.00 H new ATOM 0 HG23 ILE A 830 -8.600 5.608 2.827 1.00 0.00 H new ATOM 0 HD11 ILE A 830 -10.015 7.283 -0.285 1.00 0.00 H new ATOM 0 HD12 ILE A 830 -10.421 8.095 1.245 1.00 0.00 H new ATOM 0 HD13 ILE A 830 -8.931 7.131 1.117 1.00 0.00 H new ATOM 1942 N ASP A 831 -12.343 5.096 4.907 1.00 0.00 N ATOM 1943 CA ASP A 831 -13.174 4.947 6.095 1.00 0.00 C ATOM 1944 C ASP A 831 -12.380 4.401 7.284 1.00 0.00 C ATOM 1945 O ASP A 831 -12.890 4.348 8.404 1.00 0.00 O ATOM 1946 CB ASP A 831 -14.375 4.041 5.803 1.00 0.00 C ATOM 1947 CG ASP A 831 -15.373 4.013 6.945 1.00 0.00 C ATOM 1948 OD1 ASP A 831 -16.245 4.907 6.993 1.00 0.00 O ATOM 1949 OD2 ASP A 831 -15.283 3.099 7.790 1.00 0.00 O ATOM 0 H ASP A 831 -12.202 6.063 4.613 1.00 0.00 H new ATOM 0 HA ASP A 831 -13.533 5.941 6.364 1.00 0.00 H new ATOM 0 HB2 ASP A 831 -14.874 4.385 4.897 1.00 0.00 H new ATOM 0 HB3 ASP A 831 -14.023 3.028 5.608 1.00 0.00 H new ATOM 1954 N LYS A 832 -11.135 3.997 7.041 1.00 0.00 N ATOM 1955 CA LYS A 832 -10.286 3.461 8.101 1.00 0.00 C ATOM 1956 C LYS A 832 -10.111 4.475 9.229 1.00 0.00 C ATOM 1957 O LYS A 832 -10.865 4.388 10.221 1.00 0.00 O ATOM 1958 CB LYS A 832 -8.919 3.054 7.541 1.00 0.00 C ATOM 1959 CG LYS A 832 -8.307 4.083 6.604 1.00 0.00 C ATOM 1960 CD LYS A 832 -6.797 3.932 6.521 1.00 0.00 C ATOM 1961 CE LYS A 832 -6.196 4.883 5.499 1.00 0.00 C ATOM 1962 NZ LYS A 832 -4.717 4.982 5.635 1.00 0.00 N ATOM 1963 OXT LYS A 832 -9.224 5.348 9.112 1.00 0.00 O ATOM 0 H LYS A 832 -10.693 4.031 6.122 1.00 0.00 H new ATOM 0 HA LYS A 832 -10.777 2.577 8.508 1.00 0.00 H new ATOM 0 HB2 LYS A 832 -8.234 2.880 8.371 1.00 0.00 H new ATOM 0 HB3 LYS A 832 -9.022 2.108 7.009 1.00 0.00 H new ATOM 0 HG2 LYS A 832 -8.740 3.974 5.610 1.00 0.00 H new ATOM 0 HG3 LYS A 832 -8.555 5.086 6.951 1.00 0.00 H new ATOM 0 HD2 LYS A 832 -6.357 4.123 7.500 1.00 0.00 H new ATOM 0 HD3 LYS A 832 -6.547 2.905 6.254 1.00 0.00 H new ATOM 0 HE2 LYS A 832 -6.446 4.542 4.494 1.00 0.00 H new ATOM 0 HE3 LYS A 832 -6.639 5.872 5.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 832 -4.331 5.530 4.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 832 -4.482 5.457 6.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 832 -4.303 4.028 5.631 1.00 0.00 H new TER 1977 LYS A 832 ATOM 1978 N SER B 31 24.257 6.419 -6.847 1.00 0.00 N ATOM 1979 CA SER B 31 24.080 7.291 -8.036 1.00 0.00 C ATOM 1980 C SER B 31 23.371 6.543 -9.160 1.00 0.00 C ATOM 1981 O SER B 31 22.387 7.028 -9.717 1.00 0.00 O ATOM 1982 CB SER B 31 25.438 7.797 -8.528 1.00 0.00 C ATOM 1983 OG SER B 31 26.294 6.718 -8.860 1.00 0.00 O ATOM 0 HA SER B 31 23.464 8.141 -7.743 1.00 0.00 H new ATOM 0 HB2 SER B 31 25.298 8.436 -9.400 1.00 0.00 H new ATOM 0 HB3 SER B 31 25.903 8.410 -7.756 1.00 0.00 H new ATOM 0 HG SER B 31 27.154 7.067 -9.173 1.00 0.00 H new ATOM 1991 N THR B 32 23.878 5.358 -9.490 1.00 0.00 N ATOM 1992 CA THR B 32 23.294 4.545 -10.550 1.00 0.00 C ATOM 1993 C THR B 32 22.264 3.567 -9.994 1.00 0.00 C ATOM 1994 O THR B 32 22.155 3.387 -8.782 1.00 0.00 O ATOM 1995 CB THR B 32 24.374 3.757 -11.313 1.00 0.00 C ATOM 1996 OG1 THR B 32 25.092 2.910 -10.408 1.00 0.00 O ATOM 1997 CG2 THR B 32 25.342 4.700 -12.010 1.00 0.00 C ATOM 0 H THR B 32 24.692 4.941 -9.038 1.00 0.00 H new ATOM 0 HA THR B 32 22.801 5.232 -11.238 1.00 0.00 H new ATOM 0 HB THR B 32 23.881 3.146 -12.069 1.00 0.00 H new ATOM 0 HG1 THR B 32 25.776 2.410 -10.901 1.00 0.00 H new ATOM 0 HG21 THR B 32 26.096 4.120 -12.542 1.00 0.00 H new ATOM 0 HG22 THR B 32 24.796 5.323 -12.719 1.00 0.00 H new ATOM 0 HG23 THR B 32 25.829 5.334 -11.269 1.00 0.00 H new ATOM 2005 N GLY B 33 21.511 2.939 -10.894 1.00 0.00 N ATOM 2006 CA GLY B 33 20.496 1.986 -10.482 1.00 0.00 C ATOM 2007 C GLY B 33 19.451 1.753 -11.555 1.00 0.00 C ATOM 2008 O GLY B 33 18.868 2.703 -12.077 1.00 0.00 O ATOM 0 H GLY B 33 21.586 3.074 -11.902 1.00 0.00 H new ATOM 0 HA2 GLY B 33 20.972 1.038 -10.231 1.00 0.00 H new ATOM 0 HA3 GLY B 33 20.009 2.348 -9.577 1.00 0.00 H new ATOM 2012 N GLY B 34 19.217 0.486 -11.885 1.00 0.00 N ATOM 2013 CA GLY B 34 18.235 0.152 -12.902 1.00 0.00 C ATOM 2014 C GLY B 34 16.833 0.576 -12.514 1.00 0.00 C ATOM 2015 O GLY B 34 16.433 1.716 -12.754 1.00 0.00 O ATOM 0 H GLY B 34 19.690 -0.315 -11.467 1.00 0.00 H new ATOM 0 HA2 GLY B 34 18.510 0.633 -13.841 1.00 0.00 H new ATOM 0 HA3 GLY B 34 18.250 -0.924 -13.079 1.00 0.00 H new ATOM 2019 N VAL B 35 16.080 -0.344 -11.916 1.00 0.00 N ATOM 2020 CA VAL B 35 14.716 -0.054 -11.493 1.00 0.00 C ATOM 2021 C VAL B 35 14.667 0.374 -10.040 1.00 0.00 C ATOM 2022 O VAL B 35 14.412 1.533 -9.728 1.00 0.00 O ATOM 2023 CB VAL B 35 13.792 -1.276 -11.647 1.00 0.00 C ATOM 2024 CG1 VAL B 35 12.407 -0.952 -11.092 1.00 0.00 C ATOM 2025 CG2 VAL B 35 13.705 -1.702 -13.105 1.00 0.00 C ATOM 0 H VAL B 35 16.392 -1.294 -11.715 1.00 0.00 H new ATOM 0 HA VAL B 35 14.371 0.753 -12.139 1.00 0.00 H new ATOM 0 HB VAL B 35 14.209 -2.108 -11.080 1.00 0.00 H new ATOM 0 HG11 VAL B 35 11.758 -1.820 -11.204 1.00 0.00 H new ATOM 0 HG12 VAL B 35 12.489 -0.694 -10.036 1.00 0.00 H new ATOM 0 HG13 VAL B 35 11.984 -0.110 -11.639 1.00 0.00 H new ATOM 0 HG21 VAL B 35 13.047 -2.567 -13.193 1.00 0.00 H new ATOM 0 HG22 VAL B 35 13.306 -0.881 -13.701 1.00 0.00 H new ATOM 0 HG23 VAL B 35 14.699 -1.964 -13.468 1.00 0.00 H new HETATM 2035 OH ALY B 36 10.179 0.604 -6.262 1.00 0.00 O HETATM 2036 CH ALY B 36 9.878 0.243 -5.126 1.00 0.00 C HETATM 2037 CH3 ALY B 36 8.683 0.889 -4.422 1.00 0.00 C HETATM 2038 NZ ALY B 36 10.613 -0.617 -4.445 1.00 0.00 N HETATM 2039 CE ALY B 36 11.388 -1.666 -5.086 1.00 0.00 C HETATM 2040 CD ALY B 36 12.758 -1.205 -5.541 1.00 0.00 C HETATM 2041 CG ALY B 36 13.237 -2.032 -6.705 1.00 0.00 C HETATM 2042 CB ALY B 36 14.675 -1.712 -7.023 1.00 0.00 C HETATM 2043 CA ALY B 36 14.869 -0.366 -7.728 1.00 0.00 C HETATM 2044 N ALY B 36 14.896 -0.590 -9.163 1.00 0.00 N HETATM 2045 C ALY B 36 16.143 0.316 -7.246 1.00 0.00 C HETATM 2046 O ALY B 36 16.889 -0.259 -6.456 1.00 0.00 O HETATM 0 HH33 ALY B 36 8.853 1.961 -4.326 1.00 0.00 H new HETATM 0 HH32 ALY B 36 7.779 0.716 -5.006 1.00 0.00 H new HETATM 0 HH31 ALY B 36 8.564 0.451 -3.431 1.00 0.00 H new HETATM 0 HZ ALY B 36 10.638 -0.542 -3.428 1.00 0.00 H new HETATM 0 HG3 ALY B 36 12.613 -1.838 -7.578 1.00 0.00 H new HETATM 0 HG2 ALY B 36 13.137 -3.092 -6.471 1.00 0.00 H new HETATM 0 HE3 ALY B 36 10.835 -2.043 -5.946 1.00 0.00 H new HETATM 0 HE2 ALY B 36 11.504 -2.498 -4.392 1.00 0.00 H new HETATM 0 HD3 ALY B 36 13.466 -1.284 -4.716 1.00 0.00 H new HETATM 0 HD2 ALY B 36 12.717 -0.154 -5.827 1.00 0.00 H new HETATM 0 HCA ALY B 36 14.040 0.300 -7.488 1.00 0.00 H new HETATM 0 HB3 ALY B 36 15.083 -2.503 -7.652 1.00 0.00 H new HETATM 0 HB2 ALY B 36 15.251 -1.713 -6.097 1.00 0.00 H new HETATM 0 H ALY B 36 14.793 -1.535 -9.534 1.00 0.00 H new ATOM 2061 N LYS B 37 16.387 1.539 -7.742 1.00 0.00 N ATOM 2062 CA LYS B 37 17.563 2.319 -7.348 1.00 0.00 C ATOM 2063 C LYS B 37 17.860 2.083 -5.876 1.00 0.00 C ATOM 2064 O LYS B 37 17.234 2.690 -5.018 1.00 0.00 O ATOM 2065 CB LYS B 37 17.327 3.815 -7.596 1.00 0.00 C ATOM 2066 CG LYS B 37 18.442 4.710 -7.073 1.00 0.00 C ATOM 2067 CD LYS B 37 18.122 6.182 -7.280 1.00 0.00 C ATOM 2068 CE LYS B 37 19.257 7.072 -6.799 1.00 0.00 C ATOM 2069 NZ LYS B 37 19.504 6.918 -5.339 1.00 0.00 N ATOM 0 H LYS B 37 15.783 2.007 -8.417 1.00 0.00 H new ATOM 0 HA LYS B 37 18.414 1.998 -7.949 1.00 0.00 H new ATOM 0 HB2 LYS B 37 17.212 3.982 -8.667 1.00 0.00 H new ATOM 0 HB3 LYS B 37 16.388 4.108 -7.125 1.00 0.00 H new ATOM 0 HG2 LYS B 37 18.597 4.517 -6.012 1.00 0.00 H new ATOM 0 HG3 LYS B 37 19.375 4.465 -7.581 1.00 0.00 H new ATOM 0 HD2 LYS B 37 17.934 6.369 -8.337 1.00 0.00 H new ATOM 0 HD3 LYS B 37 17.207 6.435 -6.744 1.00 0.00 H new ATOM 0 HE2 LYS B 37 20.166 6.829 -7.348 1.00 0.00 H new ATOM 0 HE3 LYS B 37 19.020 8.113 -7.019 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 20.149 7.667 -5.015 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 18.603 6.991 -4.825 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 19.933 5.988 -5.156 1.00 0.00 H new ATOM 2083 N PRO B 38 18.821 1.198 -5.568 1.00 0.00 N ATOM 2084 CA PRO B 38 19.162 0.859 -4.190 1.00 0.00 C ATOM 2085 C PRO B 38 19.131 2.055 -3.244 1.00 0.00 C ATOM 2086 O PRO B 38 19.559 3.154 -3.599 1.00 0.00 O ATOM 2087 CB PRO B 38 20.587 0.334 -4.329 1.00 0.00 C ATOM 2088 CG PRO B 38 20.598 -0.337 -5.657 1.00 0.00 C ATOM 2089 CD PRO B 38 19.674 0.469 -6.534 1.00 0.00 C ATOM 0 HA PRO B 38 18.451 0.156 -3.756 1.00 0.00 H new ATOM 0 HB2 PRO B 38 21.316 1.143 -4.285 1.00 0.00 H new ATOM 0 HB3 PRO B 38 20.835 -0.363 -3.528 1.00 0.00 H new ATOM 0 HG2 PRO B 38 21.605 -0.365 -6.072 1.00 0.00 H new ATOM 0 HG3 PRO B 38 20.258 -1.369 -5.576 1.00 0.00 H new ATOM 0 HD2 PRO B 38 20.228 1.154 -7.176 1.00 0.00 H new ATOM 0 HD3 PRO B 38 19.082 -0.172 -7.187 1.00 0.00 H new ATOM 2097 N HIS B 39 18.621 1.830 -2.037 1.00 0.00 N ATOM 2098 CA HIS B 39 18.540 2.879 -1.027 1.00 0.00 C ATOM 2099 C HIS B 39 19.157 2.398 0.282 1.00 0.00 C ATOM 2100 O HIS B 39 19.615 3.200 1.095 1.00 0.00 O ATOM 2101 CB HIS B 39 17.085 3.288 -0.784 1.00 0.00 C ATOM 2102 CG HIS B 39 16.244 3.325 -2.023 1.00 0.00 C ATOM 2103 ND1 HIS B 39 15.433 2.279 -2.409 1.00 0.00 N ATOM 2104 CD2 HIS B 39 16.074 4.294 -2.954 1.00 0.00 C ATOM 2105 CE1 HIS B 39 14.801 2.603 -3.522 1.00 0.00 C ATOM 2106 NE2 HIS B 39 15.172 3.820 -3.872 1.00 0.00 N ATOM 0 H HIS B 39 18.256 0.927 -1.734 1.00 0.00 H new ATOM 0 HA HIS B 39 19.093 3.744 -1.393 1.00 0.00 H new ATOM 0 HB2 HIS B 39 16.637 2.592 -0.075 1.00 0.00 H new ATOM 0 HB3 HIS B 39 17.069 4.273 -0.318 1.00 0.00 H new ATOM 0 HD1 HIS B 39 15.336 1.393 -1.912 1.00 0.00 H new ATOM 0 HD2 HIS B 39 16.558 5.259 -2.970 1.00 0.00 H new ATOM 0 HE1 HIS B 39 14.100 1.978 -4.055 1.00 0.00 H new ATOM 2115 N ARG B 40 19.165 1.080 0.472 1.00 0.00 N ATOM 2116 CA ARG B 40 19.720 0.479 1.679 1.00 0.00 C ATOM 2117 C ARG B 40 19.096 1.097 2.927 1.00 0.00 C ATOM 2118 O ARG B 40 19.701 1.953 3.576 1.00 0.00 O ATOM 2119 CB ARG B 40 21.240 0.655 1.710 1.00 0.00 C ATOM 2120 CG ARG B 40 21.918 -0.087 2.852 1.00 0.00 C ATOM 2121 CD ARG B 40 23.420 0.151 2.856 1.00 0.00 C ATOM 2122 NE ARG B 40 23.753 1.548 3.124 1.00 0.00 N ATOM 2123 CZ ARG B 40 24.938 2.089 2.855 1.00 0.00 C ATOM 2124 NH1 ARG B 40 25.895 1.358 2.299 1.00 0.00 N ATOM 2125 NH2 ARG B 40 25.165 3.364 3.141 1.00 0.00 N ATOM 0 H ARG B 40 18.792 0.408 -0.198 1.00 0.00 H new ATOM 0 HA ARG B 40 19.487 -0.586 1.667 1.00 0.00 H new ATOM 0 HB2 ARG B 40 21.657 0.307 0.765 1.00 0.00 H new ATOM 0 HB3 ARG B 40 21.472 1.717 1.790 1.00 0.00 H new ATOM 0 HG2 ARG B 40 21.494 0.239 3.802 1.00 0.00 H new ATOM 0 HG3 ARG B 40 21.718 -1.155 2.763 1.00 0.00 H new ATOM 0 HD2 ARG B 40 23.885 -0.484 3.610 1.00 0.00 H new ATOM 0 HD3 ARG B 40 23.836 -0.142 1.892 1.00 0.00 H new ATOM 0 HE ARG B 40 23.036 2.142 3.541 1.00 0.00 H new ATOM 0 HH11 ARG B 40 25.723 0.378 2.076 1.00 0.00 H new ATOM 0 HH12 ARG B 40 26.802 1.776 2.094 1.00 0.00 H new ATOM 0 HH21 ARG B 40 24.431 3.930 3.567 1.00 0.00 H new ATOM 0 HH22 ARG B 40 26.074 3.779 2.935 1.00 0.00 H new ATOM 2139 N TYR B 41 17.878 0.667 3.258 1.00 0.00 N ATOM 2140 CA TYR B 41 17.184 1.190 4.428 1.00 0.00 C ATOM 2141 C TYR B 41 17.634 0.477 5.699 1.00 0.00 C ATOM 2142 O TYR B 41 18.466 0.992 6.446 1.00 0.00 O ATOM 2143 CB TYR B 41 15.661 1.074 4.265 1.00 0.00 C ATOM 2144 CG TYR B 41 14.890 1.718 5.403 1.00 0.00 C ATOM 2145 CD1 TYR B 41 15.207 3.001 5.837 1.00 0.00 C ATOM 2146 CD2 TYR B 41 13.854 1.050 6.046 1.00 0.00 C ATOM 2147 CE1 TYR B 41 14.517 3.595 6.875 1.00 0.00 C ATOM 2148 CE2 TYR B 41 13.159 1.639 7.085 1.00 0.00 C ATOM 2149 CZ TYR B 41 13.494 2.912 7.495 1.00 0.00 C ATOM 2150 OH TYR B 41 12.804 3.500 8.530 1.00 0.00 O ATOM 0 H TYR B 41 17.357 -0.037 2.735 1.00 0.00 H new ATOM 0 HA TYR B 41 17.442 2.245 4.516 1.00 0.00 H new ATOM 0 HB2 TYR B 41 15.366 1.539 3.325 1.00 0.00 H new ATOM 0 HB3 TYR B 41 15.388 0.021 4.199 1.00 0.00 H new ATOM 0 HD1 TYR B 41 16.007 3.542 5.354 1.00 0.00 H new ATOM 0 HD2 TYR B 41 13.588 0.053 5.728 1.00 0.00 H new ATOM 0 HE1 TYR B 41 14.778 4.591 7.200 1.00 0.00 H new ATOM 0 HE2 TYR B 41 12.357 1.105 7.573 1.00 0.00 H new ATOM 0 HH TYR B 41 12.114 2.884 8.855 1.00 0.00 H new ATOM 2160 N LYS B 42 17.085 -0.709 5.941 1.00 0.00 N ATOM 2161 CA LYS B 42 17.441 -1.482 7.125 1.00 0.00 C ATOM 2162 C LYS B 42 18.874 -1.995 7.030 1.00 0.00 C ATOM 2163 O LYS B 42 19.317 -2.439 5.970 1.00 0.00 O ATOM 2164 CB LYS B 42 16.475 -2.655 7.309 1.00 0.00 C ATOM 2165 CG LYS B 42 16.817 -3.538 8.498 1.00 0.00 C ATOM 2166 CD LYS B 42 15.851 -4.704 8.626 1.00 0.00 C ATOM 2167 CE LYS B 42 16.226 -5.612 9.785 1.00 0.00 C ATOM 2168 NZ LYS B 42 15.300 -6.773 9.906 1.00 0.00 N ATOM 0 H LYS B 42 16.395 -1.154 5.336 1.00 0.00 H new ATOM 0 HA LYS B 42 17.367 -0.824 7.991 1.00 0.00 H new ATOM 0 HB2 LYS B 42 15.464 -2.267 7.433 1.00 0.00 H new ATOM 0 HB3 LYS B 42 16.475 -3.262 6.403 1.00 0.00 H new ATOM 0 HG2 LYS B 42 17.833 -3.917 8.390 1.00 0.00 H new ATOM 0 HG3 LYS B 42 16.794 -2.944 9.412 1.00 0.00 H new ATOM 0 HD2 LYS B 42 14.839 -4.326 8.771 1.00 0.00 H new ATOM 0 HD3 LYS B 42 15.847 -5.278 7.699 1.00 0.00 H new ATOM 0 HE2 LYS B 42 17.245 -5.974 9.647 1.00 0.00 H new ATOM 0 HE3 LYS B 42 16.213 -5.040 10.713 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 15.591 -7.367 10.709 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 14.331 -6.429 10.063 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 15.331 -7.334 9.031 1.00 0.00 H new ATOM 2182 N CYS B 43 19.594 -1.932 8.146 1.00 0.00 N ATOM 2183 CA CYS B 43 20.978 -2.391 8.193 1.00 0.00 C ATOM 2184 C CYS B 43 21.061 -3.815 8.733 1.00 0.00 C ATOM 2185 O CYS B 43 21.121 -3.975 9.970 1.00 0.00 O ATOM 2186 CB CYS B 43 21.818 -1.452 9.060 1.00 0.00 C ATOM 2187 SG CYS B 43 23.553 -1.941 9.209 1.00 0.00 S ATOM 2188 OXT CYS B 43 21.065 -4.758 7.914 1.00 0.00 O ATOM 0 H CYS B 43 19.241 -1.567 9.031 1.00 0.00 H new ATOM 0 HA CYS B 43 21.372 -2.385 7.177 1.00 0.00 H new ATOM 0 HB2 CYS B 43 21.769 -0.447 8.641 1.00 0.00 H new ATOM 0 HB3 CYS B 43 21.378 -1.404 10.056 1.00 0.00 H new ATOM 0 HG CYS B 43 24.182 -1.085 9.959 1.00 0.00 H new TER 2194 CYS B 43